Difference between revisions of "Christian Holm"
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|researcherid=C-2134-2009 | |researcherid=C-2134-2009 | ||
|category=holm | |category=holm | ||
+ | |topical=active | ||
+ | |topical2=atomistics | ||
+ | |topical3=gel | ||
+ | |topical4=nanopore | ||
+ | |topical6=hydrodynamics | ||
+ | |ordering=1 | ||
}} | }} | ||
==Research== | ==Research== | ||
− | My scientific interests are especially the study of complex charged soft matter by means of computer simulations, and the development of simple theoretical models to describe them. More precisely I am currently working on the solution properties and association behavior of flexible and semi-flexible polyelectrolytes in various solvents and under various salt concentrations and salt types. In addition I am interested in the effective pair interactions of charged colloidal particles and their phase behavior. This includes simple DNA models, and DNA protein interactions, as well as developing coarse grained models for DNA-Histone complexes. | + | My scientific interests are especially the study of complex charged and magnetic soft matter by means of computer simulations, and the development of simple theoretical models to describe them. More precisely I am currently working on the solution properties and association behavior of flexible and semi-flexible polyelectrolytes in various solvents and under various salt concentrations and salt types. In addition I am interested in the effective pair interactions of charged colloidal particles and their phase behavior. This includes simple DNA models, and DNA protein interactions, as well as developing coarse grained models for DNA-Histone complexes. We also investigate in depth polyelectrolyte hydrogels and magnetically interacting ferrogels, as well as pure ferrofluids, where special attention is given to the structure of the solution and the magnetic response functions. Another interest is the applicability of mean-field models for the description of models with long range interactions, and possible improvements beyond the mean-field approach. This include local density functional methods based on the Poisson-Boltzmann functional, as well as strong coupling theories such as Wigner-crystal methods. In addition I am interested in the development of fast methods for the computation of long range interactions. These include pure Coulomb as well as dipolar interactions in various geometries (3D-1D), and under various boundary conditions. And least but not last, we are interested in developing fast methods to deal with fluid-structure couplings using various coupling schemes of particles to a lattice-boltzmann fluid. These can be charged fluids, as well as fluids that undergo reactions at boundaries, such as needed for active Janus-Colloids,or for catalytic particles. We also are interested to apply machine learning algorithms for the development of force-fields with almost DFT precision. |
+ | |||
+ | Some of our research is part of collaborative research centres such as: | ||
+ | |||
+ | ==Member of collaborative research centers== | ||
+ | '''SFB 716''' [http://www.sfb716.uni-stuttgart.de sfb716.uni-stuttgart.de] | ||
+ | |||
+ | '''SFB 1313''' [http://www.sfb1313.uni-stuttgart.de/ sfb1313.uni-stuttgart.de] | ||
+ | |||
+ | '''SFB 1333''' [http://www.crc1333.uni-stuttgart.de/ crc1333.uni-stuttgart.de] | ||
+ | |||
+ | '''SimTech''' [http://www.simtech.uni-stuttgart.de SimTech Cluster of Excellence] | ||
==Publications== | ==Publications== | ||
− | < | + | ResearcherID: [https://publons.com/researcher/2862679/christian-holm/ C-2134-2009] |
− | + | <span id="badgeCont90"><script type="text/javascript" src="https://publons.com/mashlets?el=badgeCont90&rid=C-2134-2009"></script></span> | |
− | + | ||
+ | Google Scholar: [https://scholar.google.com/citations?hl=en&user=cLCHds0AAAAJ Christian Holm] | ||
+ | |||
+ | ===2021=== | ||
+ | |||
+ | <bibentry pdflink="yes"> | ||
+ | zeman21a | ||
+ | feuerstein21a | ||
+ | riede21a | ||
+ | szuttor21b | ||
+ | rud21a | ||
+ | stano21a | ||
+ | weeber21a | ||
+ | wagner21a | ||
+ | tagliabue21a | ||
+ | lee21a | ||
+ | kreissl21a, | ||
+ | szuttor21a | ||
+ | kuron21a | ||
+ | tischler21a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2020=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | landsgesell20c | ||
+ | zeman20b | ||
+ | breitsprecher20a | ||
+ | landsgesell20b | ||
+ | tischler20a | ||
+ | tovey20a | ||
+ | sivaraman20a | ||
+ | sanchez20a | ||
+ | zeman20a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2019=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | smiljanic19a, | ||
+ | roy19a, | ||
+ | sanchez19a, | ||
+ | landsgesell19c, | ||
+ | arens19a, | ||
+ | zeman19a, | ||
+ | landsgesell19b, | ||
+ | weeber19b, | ||
+ | lee19a, | ||
+ | weik19b, | ||
+ | holm19a, | ||
+ | weik19a, | ||
+ | landsgesell19a, | ||
+ | sean19a, | ||
+ | weeber19a, | ||
+ | kuron19a, | ||
+ | kuron19b | ||
+ | </bibentry> | ||
+ | |||
+ | ===2018=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | hartmann18a, | ||
+ | breitsprecher18a, | ||
+ | krishnamoorthy18c, | ||
+ | michalowsky18a, | ||
+ | krishnamoorthy18b, | ||
+ | krishnamoorthy18a, | ||
+ | kuron18a, | ||
+ | smiatek18a, | ||
+ | weeber18b, | ||
+ | uhlig18a, | ||
+ | weyman18a, | ||
+ | weeber18a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2017=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | breitsprecher17a | ||
+ | sean17a | ||
+ | uhlig17a, | ||
+ | roy17b, | ||
+ | roy17a, | ||
+ | szuttor17a, | ||
+ | richter17a, | ||
+ | bauer17a, | ||
+ | landsgesell17b, | ||
+ | landsgesell17a, | ||
+ | chung17a, | ||
+ | rau17a, | ||
+ | rud17a, | ||
+ | michalowsky17a, | ||
+ | niu17a, | ||
+ | brown17a, | ||
+ | rempfer17a | ||
+ | landsgesell17b | ||
+ | landsgesell17a | ||
+ | zeman17a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2016=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | micciulla16a, | ||
+ | lesch16a, | ||
+ | huang16a, | ||
+ | kreissl16a, | ||
+ | sanchez16a, | ||
+ | degraaf16a, | ||
+ | degraaf16b, | ||
+ | rempfer16a, | ||
+ | rempfer16b, | ||
+ | breitsprecher16a, | ||
+ | bordin16a, | ||
+ | ilse16a, | ||
+ | burt16a, | ||
+ | krishnamoorthy16a, | ||
+ | weik16a, | ||
+ | kuron16a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2015=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | ryzhkov15a, | ||
+ | bauer15a, | ||
+ | breitsprecher15a, | ||
+ | fischer15a, | ||
+ | degraaf15b, | ||
+ | degraaf15c, | ||
+ | fahrenberger15b, | ||
+ | fahrenberger15c, | ||
+ | holm15a, | ||
+ | kosovan15a, | ||
+ | lesch15a, | ||
+ | lesch15b, | ||
+ | pessot15a, | ||
+ | raafatnia15a, | ||
+ | ryzhkov15a, | ||
+ | vogele15a, | ||
+ | vogele15b, | ||
+ | weeber15a, | ||
+ | weeber15c | ||
+ | </bibentry> | ||
+ | |||
+ | ===2014=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | breitsprecher14a, | ||
+ | breitsprecher14b, | ||
+ | dommert14a, | ||
+ | ertl14a, | ||
+ | fahrenberger14a, | ||
+ | fahrenberger14b, | ||
+ | hickey14a, | ||
+ | kesselheim14a, | ||
+ | krishnamoorthy14a, | ||
+ | micciulla14a, | ||
+ | raafatnia14a, | ||
+ | raafatnia14b, | ||
+ | sega14a, | ||
+ | smiatek14a, | ||
+ | smiatek14d, | ||
+ | vagias14a | ||
+ | </bibentry> | ||
+ | |||
+ | ===2013=== | ||
+ | <bibentry pdflink="yes"> | ||
+ | arnold13a, | ||
+ | arnold13b, | ||
+ | arnold13c, | ||
+ | cerda13a, | ||
+ | chakrabarti13a, | ||
+ | dommert12b, | ||
+ | dommert13a, | ||
+ | hickey13a, | ||
+ | hoepfner13b, | ||
+ | klinkigt13a, | ||
+ | kosovan13a, | ||
+ | samin13a, | ||
+ | sanchez13b, | ||
+ | sega13a, | ||
+ | semenov13a, | ||
+ | vagias13a, | ||
+ | vagias13b, | ||
+ | weeber13a | ||
+ | </bibentry> | ||
− | |||
− | |||
− | |||
− | |||
===2012=== | ===2012=== | ||
<bibentry pdflink="yes"> | <bibentry pdflink="yes"> | ||
+ | kesselheim12a, | ||
+ | bachthaler12a, | ||
+ | dellesite12a, | ||
+ | cerda12a, | ||
weeber12a, | weeber12a, | ||
− | wendler12a | + | dommert12a, |
+ | wendler12a, | ||
+ | ballenegger12a | ||
</bibentry> | </bibentry> | ||
Revision as of 11:15, 3 January 2022
Director
Office: | 1.046 |
---|---|
Phone: | +49 711 685-63701 |
Fax: | +49 711 685-53701 |
Email: | holm _at_ icp.uni-stuttgart.de |
Address: | Prof. Dr. Christian Holm Institute for Computational Physics Universität Stuttgart Allmandring 3 70569 Stuttgart Germany |
Research
My scientific interests are especially the study of complex charged and magnetic soft matter by means of computer simulations, and the development of simple theoretical models to describe them. More precisely I am currently working on the solution properties and association behavior of flexible and semi-flexible polyelectrolytes in various solvents and under various salt concentrations and salt types. In addition I am interested in the effective pair interactions of charged colloidal particles and their phase behavior. This includes simple DNA models, and DNA protein interactions, as well as developing coarse grained models for DNA-Histone complexes. We also investigate in depth polyelectrolyte hydrogels and magnetically interacting ferrogels, as well as pure ferrofluids, where special attention is given to the structure of the solution and the magnetic response functions. Another interest is the applicability of mean-field models for the description of models with long range interactions, and possible improvements beyond the mean-field approach. This include local density functional methods based on the Poisson-Boltzmann functional, as well as strong coupling theories such as Wigner-crystal methods. In addition I am interested in the development of fast methods for the computation of long range interactions. These include pure Coulomb as well as dipolar interactions in various geometries (3D-1D), and under various boundary conditions. And least but not last, we are interested in developing fast methods to deal with fluid-structure couplings using various coupling schemes of particles to a lattice-boltzmann fluid. These can be charged fluids, as well as fluids that undergo reactions at boundaries, such as needed for active Janus-Colloids,or for catalytic particles. We also are interested to apply machine learning algorithms for the development of force-fields with almost DFT precision.
Some of our research is part of collaborative research centres such as:
Member of collaborative research centers
SFB 716 sfb716.uni-stuttgart.de
SFB 1313 sfb1313.uni-stuttgart.de
SFB 1333 crc1333.uni-stuttgart.de
SimTech SimTech Cluster of Excellence
Publications
ResearcherID: C-2134-2009 <script type="text/javascript" src="https://publons.com/mashlets?el=badgeCont90&rid=C-2134-2009"></script>
Google Scholar: Christian Holm
2021
-
Zeman,Johannes and Kondrat,Svyatoslav and Holm,Christian.
"Ionic screening in bulk and under confinement".
The Journal of Chemical Physics 155(20)(204501), 2021.
[PDF] (11 MB) [DOI] -
Feuerstein, Linda and Biermann, Carl Georg and Xiao, Zuyao and Holm, Christian and Simmchen, Juliane.
"Highly Efficient Active Colloids Driven by Galvanic Exchange Reactions".
Journal of the American Chemical Society 143(41)(17015-17022), 2021.
[PDF] (15 MB) [DOI] -
Riede, Julia M. and Holm, Christian and Schmitt, Syn and Haeufle, Daniel F. B..
"The control effort to steer self-propelled microswimmers depends on their morphology: comparing symmetric spherical versus asymmetric L-shaped particles".
Royal Society Open Science 8(9)(201839), 2021.
[PDF] (994 KB) [DOI] -
Kai Szuttor and Patrick Kreissl and Christian Holm.
"A numerical investigation of analyte size effects in nanopore sensing systems".
The Journal of Chemical Physics 155(13)(134902), 2021.
[PDF] (5 MB) [DOI] -
Oleg V. Rud and Jonas Landsgesell and Christian Holm and Peter Košovan.
"Modeling of weak polyelectrolyte hydrogels under compression, Implications for water desalination".
Desalination 506(114995), 2021.
[DOI] -
Sta\vno, Roman and Košovan, Peter and Tagliabue, Andrea and Holm, Christian.
"Electrostatically Cross-Linked Reversible Gels—Effects of pH and Ionic Strength".
Macromolecules 54(10)(4769-4781), 2021.
[PDF] (5 MB) [DOI] -
Rudolf Weeber and Patrick Kreissl and Christian Holm.
"Magnetic field controlled behavior of magnetic gels studied using particle-based simulations".
Physical Sciences Reviews (20190106), 2021.
[DOI] -
Wagner, Arndt and Eggenweiler, Elissa and Weinhardt, Felix and Trivedi, Zubin and Krach, David and Lohrmann, Christoph and Jain, Kartik and Karadimitriou, Nikolaos and Bringedal, Carina and Voland, Paul and Holm, Christian and Class, Holger and Steeb, Holger and Rybak, Iryna.
"Permeability Estimation of Regular Porous Structures: A Benchmark for Comparison of Methods".
Transport in Porous Media , 2021.
[PDF] (2 MB) [DOI] -
Tagliabue, Andrea and Landsgesell, Jonas and Mella, Massimo and Holm, Christian.
"Can oppositely charged polyelectrolyte stars form a gel? A simulational study".
Soft Matter 17(1574-1588), 2021.
[PDF] (6 MB) [DOI] -
Lee, Miru and Lohrmann, Christoph and Szuttor, Kai and Auradou, Harold and Holm, Christian.
"The influence of motility on bacterial accumulation in a microporous channel".
Soft Matter 17(893-902), 2021.
[PDF] (4 MB) [DOI] -
Kreissl, Patrick and Holm, Christian and Weeber, Rudolf.
"Frequency-dependent magnetic susceptibility of magnetic nanoparticles in a polymer solution: a simulation study".
Soft Matter 17(174–183), 2021.
[PDF] (3 MB) [DOI] [URL] -
Kai Szuttor and Florian Weik and Jean-Noël Grad and Christian Holm.
"Modeling the current modulation of bundled DNA structures in nanopores".
The Journal of Chemical Physics 154(5)(054901), 2021.
[PDF] (3 MB) [DOI] -
Michael Kuron and Cameron Stewart and Joost de Graaf and Christian Holm.
"An extensible lattice Boltzmann method for viscoelastic flows: complex and moving boundaries in Oldroyd-B fluids".
European Physical Journal E 44(1), 2021.
[PDF] (2 MB) [DOI] -
Ingo Tischler and Alexander Schlaich and Christian Holm.
"The Presence of a Wall Enhances the Probability for Ring-Closing Metathesis: Insights from Classical Polymer Theory and Atomistic Simulations".
Macromolecular Theory and Simulations 30(2)(2000076), 2021.
[PDF] (2 MB) [DOI]
2020
-
Landsgesell, Jonas and Sean, David and Kreissl, Patrick and Szuttor, Kai and Holm, Christian.
"Erratum: Modeling Gel Swelling Equilibrium in the Mean Field: From Explicit to Poisson-Boltzmann Models [Phys. Rev. Lett. 122, 208002 (2019)]".
Physical Review Letters 124(119901), 2020.
[PDF] (255 KB) [DOI] -
Zeman, Johannes and Kondrat, Svyatoslav and Holm, Christian.
"Bulk ionic screening lengths from extremely large-scale molecular dynamics simulations".
Chemical Communications 56(15635–15638), 2020.
[PDF] (3 MB) [DOI] -
Breitsprecher, Konrad and Janssen, Mathijs and Srimuk, Pattarachai and Mehdi, B. Layla and Presser, Volker and Holm, Christian and Kondrat, Svyatoslav.
"How to speed up ion transport in nanopores".
Nature Communications 11(1)(6085), 2020.
[PDF] (2 MB) [DOI] -
Landsgesell, Jonas and Hebbeker, Pascal and Rud, Oleg and Lunkad, Raju and Kosovan, Peter and Holm, Christian.
"Grand-Reaction Method for Simulations of Ionization Equilibria Coupled to Ion Partitioning".
Macromolecules 53(8)(3007-3020), 2020.
[PDF] (2 MB) [DOI] -
Tovey, Samuel and Narayanan Krishnamoorthy, Anand and Sivaraman, Ganesh and Guo, Jicheng and Benmore, Chris and Heuer, Andreas and Holm, Christian.
"DFT Accurate Interatomic Potential for Molten NaCl from Machine Learning".
The Journal of Physical Chemistry C 124(47)(25760-25768), 2020.
[PDF] (2 MB) [DOI] -
Sivaraman, Ganesh and Krishnamoorthy, Anand Narayanan and Baur, Matthias and Holm, Christian and Stan, Marius and Csányi, Gábor and Benmore, Chris and Vázquez-Mayagoitia, Álvaro.
"Machine-learned interatomic potentials by active learning: amorphous and liquid hafnium dioxide".
npj Computational Materials 6(1)(104), 2020.
[PDF] (2 MB) [DOI] -
Sánchez, Pedro A. and Vögele, Martin and Smiatek, Jens and Qiao, Baofu and Sega, Marcello and Holm, Christian.
"PDADMAC/PSS Oligoelectrolyte Multilayers: Internal Structure and Hydration Properties at Early Growth Stages from Atomistic Simulations".
Molecules 25(8), 2020.
[PDF] (4 MB) [DOI] [URL] -
Zeman, Johannes and Holm, Christian and Smiatek, Jens.
"The Effect of Small Organic Cosolutes on Water Structure and Dynamics".
Journal of Chemical & Engineering Data 65(3)(1197–1210), 2020.
[PDF] (2 MB) [DOI]
2019
-
Smiljanic, Milena and Weeber, Rudolf and Pflüger, Dirk and Holm, Christian and Kronenburg, Andreas.
"Developing coarse-grained models for agglomerate growth".
European Physical Journal Special Topics 227(14)(1515–1527), 2019.
[PDF] (894 KB) [DOI] -
Roy, Tamal and Szuttor, Kai and Smiatek, Jens and Holm, Christian and Hardt, Steffen.
"Conformation and Dynamics of Long-Chain End-Tethered Polymers in Microchannels".
Polymers 11(3)(488), 2019.
[PDF] (3 MB) [DOI] -
Sánchez, Pedro A. and Vögele, Martin and Smiatek, Jens and Qiao, Baofu and Sega, Marcello and Holm, Christian.
"Atomistic simulation of PDADMAC/PSS oligoelectrolyte multilayers: overall comparison of tri- and tetra-layer systems".
Soft Matter 15(9437–9451), 2019.
[PDF] (7 MB) [DOI] -
Landsgesell, Jonas and Holm, Christian.
"Cell Model Approaches for Predicting the Swelling and Mechanical Properties of Polyelectrolyte Gels".
Macromolecules 52(23)(9341-9353), 2019.
[PDF] (3 MB) [DOI] -
L. Arens and D. Barther and J. Landsgesell and C. Holm and M. Wilhelm.
"Poly(sodium acrylate) hydrogels: synthesis of various network architectures, local molecular dynamics, salt partitioning, desalination and simulation".
Soft Matter 15(9949–9964), 2019.
[PDF] (6 MB) [DOI] -
Landsgesell, Jonas and Sean, David and Kreissl, Patrick and Szuttor, Kai and Holm, Christian.
"Modeling Gel Swelling Equilibrium in the Mean Field: From Explicit to Poisson-Boltzmann Models".
Physical Review Letters 122(208002), 2019.
[PDF] (500 KB) [DOI] -
Weeber, Rudolf and Nestler, Franziska and Weik, Florian and Pippig, Michael and Potts, Daniel and Holm, Christian.
"Accelerating the calculation of dipolar interactions in particle based simulations with open boundary conditions by means of the P2NFFT method".
Journal of Computational Physics 391, 2019.
[PDF] (12 MB) [DOI] -
Lee, Miru and Szuttor, Kai and Holm, Christian.
"A computational model for bacterial run-and-tumble motion".
The Journal of Chemical Physics 150(174111), 2019.
[PDF] (2 MB) [DOI] -
Weik, Florian and Szuttor, Kai and Landsgesell, Jonas and Holm, Christian.
"Modeling the current modulation of dsDNA in nanopores – from mean-field to atomistic and back".
European Physical Journal Special Topics 227(14)(1639–1655), 2019.
[PDF] (576 KB) [DOI] -
Holm, Christian and Ertl, Thomas and Schmauder, Siegfried and Kästner, Johannes and Gross, Joachim.
"Particle methods in natural science and engineering".
European Physical Journal Special Topics 227(14)(1493–1499), 2019.
[PDF] (124 KB) [DOI] -
Weik, Florian and Weeber, Rudolf and Szuttor, Kai and Breitsprecher, Konrad and de Graaf, Joost and Kuron, Michael and Landsgesell, Jonas and Menke, Henri and Sean, David and Holm, Christian.
"ESPResSo 4.0 – an extensible software package for simulating soft matter systems".
European Physical Journal Special Topics 227(14)(1789–1816), 2019.
[PDF] (2 MB) [DOI] -
Landsgesell, Jonas and Nova, Lucie and Rud, Oleg and Uhlik, Filip and Sean, David and Hebbeker, Pascal and Holm, Christian and Košovan, Peter.
"Simulations of ionization equilibria in weak polyelectrolyte solutions and gels".
Soft Matter 15(6)(1155-1185), 2019.
[PDF] (7 MB) [DOI] -
Sean, David and Landsgesell, Jonas and Holm, Christian.
"Influence of weak groups on polyelectrolyte mobilities".
Electrophoresis 40(5)(799–809), 2019.
[PDF] (994 KB) [DOI] -
Weeber, Rudolf and Kreissl, Patrick and Holm, Christian.
"Studying the field-controlled change of shape and elasticity of magnetic gels using particle-based simulations".
Archive of Applied Mechanics 89(1)(3–16), 2019.
[PDF] (3 MB) [DOI] [URL] -
Michael Kuron and Philipp Stärk and Christian Burkard and Joost de Graaf and Christian Holm.
"A lattice Boltzmann model for squirmers".
The Journal of Chemical Physics 150(144110), 2019.
[PDF] (2 MB) [DOI] -
Kuron, Michael and Stärk, Philipp and Holm, Christian and de Graaf, Joost.
"Hydrodynamic mobility reversal of squirmers near flat and curved surfaces".
Soft Matter 15(5908–5920), 2019.
[PDF] (5 MB) [DOI]
2018
-
Hartmann, Johannes and Roy, Tamal and Szuttor, Kai and Smiatek, Jens and Holm, Christian and Hardt, Steffen.
"Relaxation of surface-tethered polymers under moderate confinement".
Soft Matter 14(38)(7926–7933), 2018.
[PDF] (3 MB) [DOI] -
Breitsprecher, Konrad and Holm, Christian and Kondrat, Svyatoslav.
"Charge Me Slowly, I Am in a Hurry: Optimizing Charge-Discharge Cycles in Nanoporous Supercapacitors".
ACS Nano 12(10)(9733–9741), 2018.
[PDF] (4 MB) [DOI] -
Krishnamoorthy, Anand Narayanan and Oldiges, Kristina and Winter, Martin and Heuer, Andreas and Cekic-Laskovic, Isidora and Holm, Christian and Smiatek, Jens.
"Electrolyte solvents for high voltage lithium ion batteries: ion correlation and specific anion effects in adiponitrile".
Physical Chemistry Chemical Physics 20(25701–25715), 2018.
[PDF] (3 MB) [DOI] -
Julian Michalowsky and Johannes Zeman and Christian Holm and Jens Smiatek.
"A polarizable MARTINI model for monovalent ions in aqueous solution".
The Journal of Chemical Physics 149(16)(163319), 2018.
[PDF] (2 MB) [DOI] -
Narayanan Krishnamoorthy, Anand and Holm, Christian and Smiatek, Jens.
"Influence of Cosolutes on Chemical Equilibrium: a Kirkwood-Buff Theory for Ion Pair Association-Dissociation Processes in Ternary Electrolyte Solutions".
The Journal of Physical Chemistry C 122(19)(10293–10302), 2018.
[PDF] (717 KB) [DOI] -
Krishnamoorthy, Anand Narayanan and Holm, Christian and Smiatek, Jens.
"Specific ion effects for polyelectrolytes in aqueous and non-aqueous media: the importance of the ion solvation behavior".
Soft Matter 14(30)(6243–6255), 2018.
[PDF] (5 MB) [DOI] -
Kuron, Michael and Kreissl, Patrick and Holm, Christian.
"Toward Understanding of Self-Electrophoretic Propulsion under Realistic Conditions: From Bulk Reactions to Confinement Effects".
Accounts of Chemical Research 51(12)(2998–3005), 2018.
[PDF] (4 MB) [DOI] -
Smiatek, Jens and Holm, Christian.
"From the Atomistic to the Macromolecular Scale: Distinct Simulation Approaches for Polyelectrolyte Solutions".
In Handbook of Materials Modeling: Methods: Theory and Modeling, pages 1–15.
Springer International Publishing, Cham, 2018.
[PDF] (368 KB) [DOI] -
Uhlig, Frank and Zeman, Johannes and Smiatek, Jens and Holm, Christian.
"First-Principles Parametrization of Polarizable Coarse-Grained Force Fields for Ionic Liquids".
Journal of Chemical Theory and Computation 14(3)(1471–1486), 2018.
[PDF] (2 MB) [DOI] -
Alexander Weyman and Markus Bier and Christian Holm and Jens Smiatek.
"Microphase Separation and the Formation of Ion Conductivity Channels in Poly(Ionic Liquid)s: A Coarse-Grained Molecular Dynamics Study".
The Journal of Chemical Physics 148(19), 2018.
[PDF] (4 MB) [DOI] -
Weeber, Rudolf and Hermes, Melissa and Schmidt, Annette M. and Holm, Christian.
"Polymer architecture of magnetic gels: a review".
Journal of Physics: Condensed Matter 30(6)(063002), 2018.
[PDF] (4 MB) [DOI]
2017
-
Konrad Breitsprecher and Manuel Abele and Svystolsav Kondrat and Christian Holm.
"The effect of finite pore length on ion structure and charging".
The Journal of Chemical Physics 147(10)(104708), 2017.
[PDF] (4 MB) [DOI] -
David Sean and Jonas Landsgesell and Christian Holm.
"Computer Simulations of Static and Dynamical Properties of Weak Polyelectrolyte Nanogels in Salty Solutions".
Gels 4(2)(2), 2018.
[PDF] (976 KB) [DOI] -
Uhlig, Frank and Smiatek, Jens and Holm, Christian.
"Many-body effects in simulations of ionic liquids".
In Proceedings of the 3rd bwHPC-Symposium, Heidelberg 2016, pages 121–123.
heiBOOKS, 2017.
[PDF] (2 MB) [DOI] -
Tamal Roy and Kai Szuttor and Jens Smiatek and Christian Holm and Steffen Hardt.
"Electric-field-induced stretching of surface-tethered polyelectrolytes in a microchannel".
Physical Review E 96(3)(032503), 2017.
[PDF] (794 KB) [DOI] -
Roy, Tamal and Szuttor, Kai and Smiatek, Jens and Holm, Christian and Hardt, Steffen.
"Stretching of surface-tethered polymers in pressure-driven flow under confinement".
Soft Matter 13(6189–6196), 2017.
[PDF] (3 MB) [DOI] -
Kai Szuttor and Tamal Roy and Steffen Hardt and Christian Holm and Jens Smiatek.
"The stretching force on a tethered polymer in pressure-driven flow".
The Journal of Chemical Physics 147(3)(034902), 2017.
[PDF] (1005 KB) [DOI] -
Tobias Richter and Jonas Landsgesell and Peter Košovan and Christian Holm.
"On the efficiency of a hydrogel-based desalination cycle".
Desalination 414(28–34), 2017.
[PDF] (2 MB) [DOI] [URL] -
Bauer, Gernot and Gribova, Nadezhda and Lange, Alexander and Holm, Christian and Gross, Joachim.
"Three-body effects in triplets of capped gold nanocrystals".
Molecular Physics 115(9-12)(1031–1040), 2017.
[PDF] (2 MB) [DOI] -
Landsgesell, Jonas and Holm, Christian and Smiatek, Jens.
"Simulation of weak polyelectrolytes: A comparison between the constant pH and the reaction ensemble method".
European Physical Journal Special Topics 226(725–736), 2017.
[PDF] (287 KB) [DOI] -
Landsgesell, Jonas and Holm, Christian and Smiatek, Jens.
"Wang-Landau Reaction Ensemble Method: Simulation of Weak Polyelectrolytes and General Acid-Base Reactions".
Journal of Chemical Theory and Computation 13(2)(852–862), 2017.
[PDF] (3 MB) [DOI] -
Chung, Salomon and Samin, Sela and Holm, Christian and Malherbe, Jean-Guillaume and Amokrane, Saïd.
"Dynamics of field-driven population inversion in a confined colloidal mixture".
Physical Review E 95(2)(022605), 2017.
[PDF] (3 MB) [DOI] -
Rau, Tobias and Weik, Florian and Holm, Christian.
"A dsDNA model optimized for electrokinetic applications".
Soft Matter 13(3918–3926), 2017.
[PDF] (4 MB) [DOI] -
Rud, Oleg and Richter, Tobias and Borisov, Oleg and Holm, Christian and Košovan, Peter.
"A self-consistent mean-field model for polyelectrolyte gels".
Soft Matter 13(18)(3264–3274), 2017.
[PDF] (4 MB) [DOI] -
Julian Michalowsky and Lars V. Schäfer and Christian Holm and Jens Smiatek.
"A refined polarizable water model for the coarse-grained MARTINI force field with long-range electrostatic interactions".
The Journal of Chemical Physics 146(5)(054501), 2017.
[PDF] (512 KB) [DOI] -
Niu, Ran and Kreissl, Patrick and Brown, Aidan Thomas and Rempfer, Georg and Botin, Denis and Holm, Christian and Palberg, Thomas and de Graaf, Joost.
"Microfluidic pumping by micromolar salt concentrations".
Soft Matter 13(1505–1518), 2017.
[PDF] (5 MB) [DOI] -
Brown, Aidan T. and Poon, Wilson C. K. and Holm, Christian and de Graaf, Joost.
"Ionic screening and dissociation are crucial for understanding chemical self-propulsion in polar solvents".
Soft Matter 13(1200–1222), 2017.
[PDF] (5 MB) [DOI] -
Rempfer, Georg and Ehrhardt, Sascha and Holm, Christian and de Graaf, Joost.
"Nanoparticle Translocation through Conical Nanopores: A Finite Element Study of Electrokinetic Transport".
Macromolecular Theory and Simulations 26(1)(1600051), 2017.
[PDF] (2 MB) [DOI] -
Landsgesell, Jonas and Holm, Christian and Smiatek, Jens.
"Simulation of weak polyelectrolytes: A comparison between the constant pH and the reaction ensemble method".
European Physical Journal Special Topics 226(725–736), 2017.
[PDF] (287 KB) [DOI] -
Landsgesell, Jonas and Holm, Christian and Smiatek, Jens.
"Wang-Landau Reaction Ensemble Method: Simulation of Weak Polyelectrolytes and General Acid-Base Reactions".
Journal of Chemical Theory and Computation 13(2)(852–862), 2017.
[PDF] (3 MB) [DOI] -
Johannes Zeman and Frank Uhlig and Jens Smiatek and Christian Holm.
"A coarse-grained polarizable force field for the ionic liquid 1-butyl-3-methylimidazolium hexafluorophosphate".
Journal of Physics: Condensed Matter 29(50)(504004), 2017.
[PDF] (2 MB) [DOI]
2016
-
Micciulla, Samantha and Michalowsky, Julian and Schroer, Martin A. and Holm, Christian and von Klitzing, Regine and Smiatek, Jens.
"Concentration dependent effects of urea binding to poly(N-isopropylacrylamide) brushes: a combined experimental and numerical study".
Physical Chemistry Chemical Physics 18(5324–5335), 2016.
[PDF] (3 MB) [DOI] -
Lesch, Volker and Heuer, Andreas and Holm, Christian and Smiatek, Jens.
"Properties of Apolar Solutes in Alkyl Imidazolium-Based Ionic Liquids: The Importance of Local Interactions".
ChemPhysChem 17(3)(387–394), 2016.
[PDF] (2 MB) [DOI] [URL] -
Huang, Shilin and Pessot, Giorgio and Cremer, Peet and Weeber, Rudolf and Holm, Christian and Nowak, Johannes and Odenbach, Stefan and Menzel, Andreas M. and Auernhammer, Günter K..
"Buckling of paramagnetic chains in soft gels".
Soft Matter 12(1)(228–237), 2016.
[PDF] (3 MB) [DOI] -
Kreissl, Patrick and Holm, Christian and de Graaf, Joost.
"The efficiency of self-phoretic propulsion mechanisms with surface reaction heterogeneity".
The Journal of Chemical Physics 144(20)(204902), 2016.
[PDF] (2 MB) [DOI] -
Sánchez, Pedro A. and Smiatek, Jens and Qiao Baofu and Sega, Marcello and Holm, Christian.
"Atomistic Simulation of Oligoelectrolyte Multilayers Growth".
In High Performance Computing in Science and Engineering '15: Transactions of the High Performance Computing Center, Stuttgart (HLRS) 2015, pages 215–228. Editors: Nagel, E. Wolfgang and Kröner, H. Dietmar and Resch, M. Michael,
Springer International Publishing, 2016.
[PDF] (292 KB) [DOI] -
de Graaf, Joost and Menke, Henri and Mathijssen, Arnold J. T. M. and Fabritius, Marc and Holm, Christian and Shendruk, Tyler N..
"Lattice-Boltzmann hydrodynamics of anisotropic active matter".
The Journal of Chemical Physics 144(13)(134106), 2016.
[PDF] (2 MB) [DOI] -
de Graaf, Joost and Mathijssen, Arnold J. T. M. and Fabritius, Marc and Menke, Henri and Holm, Christian and Shendruk, Tyler N..
"Understanding the onset of oscillatory swimming in microchannels".
Soft Matter 12(21)(4704–4708), 2016.
[PDF] (3 MB) [DOI] -
Rempfer, Georg and Davies, Gary B. and Holm, Christian and de Graaf, Joost.
"Reducing spurious flow in simulations of electrokinetic phenomena".
The Journal of Chemical Physics 145(4)(044901), 2016.
[PDF] (4 MB) [DOI] -
Rempfer, Georg and Ehrhardt, Sascha and Laohakunakorn, Nadanai and Davies, Gary B. and Keyser, Ulrich F. and Holm, Christian and de Graaf, Joost.
"Selective Trapping of DNA Using Glass Microcapillaries".
Langmuir 32(33)(8525–8532), 2016.
[PDF] (5 MB) [DOI] -
Breitsprecher, Konrad and Krishnamoorthy, Anand Narayanan and Smiatek, Jens and Holm, Christian.
"Force Field Optimization for Ionic Liquids: FFOIL".
In High Performance Computing in Science and Engineering '15, pages 101–117.
Springer, 2016.
[PDF] (2 MB) [DOI] -
Bordin, José Rafael and Podgornik, Rudolf and Holm, Christian.
"Static polarizability effects on counterion distributions near charged dielectric surfaces: A coarse-grained Molecular Dynamics study employing the Drude model".
European Physical Journal Special Topics 225(8)(1693–1705), 2016.
[PDF] (669 KB) [DOI] -
Ilse, Sven Erik and Holm, Christian and de Graaf, Joost.
"Surface roughness stabilizes the clustering of self-propelled triangles".
The Journal of Chemical Physics 145(13)(134904), 2016.
[PDF] (14 MB) [DOI] -
Ryan Burt and Konrad Breitsprecher and Barbara Daffos and Pierre-Louis Taberna and Patrice Simon and Greg Birkett and Xiu Song Zhao and Christian Holm and Mathieu Salanne.
"Capacitance of Nanoporous Carbon-Based Supercapacitors Is a Trade-Off between the Concentration and the Separability of the Ions".
The Journal of Physical Chemistry Letters 7(19)(4015–4021), 2016.
[PDF] (483 KB) [DOI] -
Krishnamoorthy, Anand Narayanan and Zeman, Johannes and Holm, Christian and Smiatek, Jens.
"Preferential solvation and ion association properties in aqueous dimethyl sulfoxide solutions".
Physical Chemistry Chemical Physics 18(31312–31322), 2016.
[PDF] (4 MB) [DOI] -
Weik, Florian and Kesselheim, Stefan and Holm, Christian.
"A coarse-grained DNA model for the prediction of current signals in DNA translocation experiments".
The Journal of Chemical Physics 145(19)(194106), 2016.
[PDF] (3 MB) [DOI] -
Michael Kuron and Georg Rempfer and Florian Schornbaum and Martin Bauer and Christian Godenschwager and Christian Holm and Joost de Graaf.
"Moving charged particles in lattice Boltzmann-based electrokinetics".
The Journal of Chemical Physics 145(21)(214102), 2016.
[PDF] (718 KB) [DOI]
2015
-
Aleksandr V. Ryzhkov and Petr V. Melenev and Christian Holm and Yuriy L. Raikher.
"Coarse-grained molecular dynamics simulation of small ferrogel objects".
Journal of Magnetism and Magnetic Materials 383(277–280), 2015.
[PDF] (2 MB) [DOI] -
Bauer, Gernot and Lange, Alexander and Gribova, Nadezhda and Holm, Christian and Gross, Joachim.
"Effective potentials between gold nano crystals - functional dependence on temperature".
Molecular Simulation 41(14)(1153–1158), 2015.
[PDF] (199 KB) [DOI] -
Breitsprecher, Konrad and Szuttor, Kai and Holm, Christian.
"Electrode Models for Ionic Liquid-Based Capacitors".
The Journal of Chemical Physics C 119(22445–22451), 2015.
[PDF] (2 MB) [DOI] -
Fischer, Lukas P. and Peter, Toni and Holm, Christian and de Graaf, Joost.
"The raspberry model for hydrodynamic interactions revisited. I. Periodic arrays of spheres and dumbbells".
The Journal of Chemical Physics 143(8)(084107), 2015.
[PDF] (3 MB) [DOI] -
de Graaf, Joost and Peter, Toni and Fischer, Lukas P. and Holm, Christian.
"The raspberry model for hydrodynamic interactions revisited. II. The effect of confinement".
The Journal of Chemical Physics 143(8)(084108), 2015.
[PDF] (818 KB) [DOI] [URL] -
de Graaf, Joost and Rempfer, Georg and Holm, Christian.
"Diffusiophoretic Self-Propulsion for Partially Catalytic Spherical Colloids".
IEEE Transactions on NanoBioscience 14(3)(272–288), 2015.
[PDF] (3 MB) [DOI] -
Fahrenberger, Florian and Hickey, Owen A. and Smiatek, Jens and Holm, Christian.
"Importance of varying permittivity on the conductivity of polyelectrolyte solutions".
Physical Review Letters 115(118301), 2015.
[PDF] (523 KB) [DOI] [URL] -
Fahrenberger, Florian and Hickey, Owen A. and Smiatek, Jens and Holm, Christian.
"The influence of charged-induced variations in the local permittivity on the static and dynamic properties of polyelectrolyte solutions".
The Journal of Chemical Physics 143(24)(243140), 2015.
[PDF] (2 MB) [DOI] -
Holm, Christian and Gompper, Gerhard and Dill, Ken A..
"Preface: Special Topic on Coarse Graining of Macromolecules, Biopolymers, and Membranes".
The Journal of Chemical Physics 143(24)(242901), 2015.
[PDF] (311 KB) [DOI] -
Peter Košovan and Tobias Richter and Christian Holm.
"Modeling of Polyelectrolyte Gels in Equilibrium with Salt Solutions".
Macromolecules 48(20)(7698–7708), 2015.
[PDF] (3 MB) [DOI] -
Lesch, Volker and Heuer, Andreas and Holm, Christian and Smiatek, Jens.
"Solvent effects of 1-ethyl-3-methylimidazolium acetate: solvation and dynamic behavior of polar and apolar solutes".
Physical Chemistry Chemical Physics 17(8480–8490), 2015.
[PDF] (3 MB) [DOI] -
Lesch, Volker and Heuer, Andreas and Tatsis, Vasileios A. and Holm, Christian and Smiatek, Jens.
"Peptides in the presence of aqueous ionic liquids: tunable co-solutes as denaturants or protectants?".
Physical Chemistry Chemical Physics 17(39)(26049–26053), 2015.
[PDF] (2 MB) [DOI] -
Pessot, Giorgio and Weeber, Rudolf and Holm, Christian and Löwen, Hartmut and Menzel, Andreas M..
"Towards a scale-bridging description of ferrogels and magnetic elastomers".
Journal of Physics: Condensed Matter 27(32)(325105), 2015.
[PDF] (2 MB) [DOI] -
Raafatnia, Shervin and Hickey, Owen A. and Holm, Christian.
"Electrophoresis of a Spherical Polyelectrolyte-Grafted Colloid in Monovalent Salt Solutions: Comparison of Molecular Dynamics Simulations with Theory and Numerical Calculations".
Macromolecules 48(3)(775–787), 2015.
[PDF] (3 MB) [DOI] -
Aleksandr V. Ryzhkov and Petr V. Melenev and Christian Holm and Yuriy L. Raikher.
"Coarse-grained molecular dynamics simulation of small ferrogel objects".
Journal of Magnetism and Magnetic Materials 383(277–280), 2015.
[PDF] (2 MB) [DOI] -
Vögele, Martin and Holm, Christian and Smiatek, Jens.
"Properties of the polarizable MARTINI water model: A comparative study for aqueous electrolyte solutions".
Journal of Molecular Liquids 212(103–110), 2015.
[PDF] (792 KB) [DOI] -
Vögele, Martin and Holm, Christian and Smiatek, Jens.
"Coarse-grained simulations of polyelectrolyte complexes: MARTINI models for poly(styrene sulfonate) and poly(diallyldimethylammonium)".
The Journal of Chemical Physics 143(24)(243151), 2015.
[PDF] (910 KB) [DOI] -
Weeber, Rudolf and Kantorovich, Sofia and Holm, Christian.
"Ferrogels cross-linked by magnetic nanoparticles – Deformation mechanisms in two and three dimensions studied by means of computer simulations".
Journal of Magnetism and Magnetic Materials 383(262–266), 2015.
[PDF] (3 MB) [DOI] -
Weeber, Rudolf and Kantorovich, Sofia and Holm, Christian.
"Ferrogels cross-linked by magnetic particles: Field-driven deformation and elasticity studied using computer simulations".
The Journal of Chemical Physics 143(15)(154901), 2015.
[PDF] (4 MB) [DOI]
2014
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Konrad Breitsprecher and Peter Košovan and Christian Holm.
"Coarse-grained simulations of an ionic liquid-based capacitor I: density, ion size, and valency effects".
Journal of Physics: Condensed Matter 26(28)(284108), 2014.
[PDF] (2 MB) [DOI] -
Konrad Breitsprecher and Peter Košovan and Christian Holm.
"Coarse-grained simulations of an ionic liquid-based capacitor II: asymmetry in ion shape and charge localization".
Journal of Physics: Condensed Matter 26(28)(284114), 2014.
[PDF] (2 MB) [DOI] -
Dommert, Florian and Wendler, Katharina and Qiao, Baofu and Delle Site, Luigi and Holm, Christian.
"Generic force fields for ionic liquids".
Journal of Molecular Liquids 192(32–37), 2014.
[PDF] (711 KB) [DOI] -
Ertl, Thomas and Krone, Michael and Kesselheim, Stefan and Scharnowski, Katrin and Reina, Guido and Holm, Christian.
"Visual Analysis for Space-Time Aggregation of Biomolecular Simulations".
Faraday Discussions 169(167–178), 2014.
[PDF] (3 MB) [DOI] -
Fahrenberger, Florian and Holm, Christian.
"Computing the Coulomb interaction in inhomogeneous dielectric media via a local electrostatics lattice algorithm".
Physical Review E 90(063304), 2014.
[PDF] (896 KB) [DOI] -
Fahrenberger, Florian and Xu, Zhenli and Holm, Christian.
"Simulation of electric double layers around charged colloids in aqueous solution of variable permittivity".
The Journal of Chemical Physics 141(6)(064902), 2014.
[PDF] (986 KB) [DOI] -
Hickey, Owen A. and Holm, Christian and Smiatek, Jens.
"Lattice-Boltzmann simulations of the electrophoretic stretching of polyelectrolytes: The importance of hydrodynamic interactions".
The Journal of Chemical Physics 140(16)(164904), 2014.
[PDF] (739 KB) [DOI] -
Kesselheim, Stefan and Müller, Wojciech and Holm, Christian.
"Origin of Current Blockades in Nanopore Translocation Experiments".
Physical Review Letters 112(018101), 2014.
[PDF] (351 KB) [DOI] -
Narayanan Krishnamoorthy, Anand and Holm, Christian and Smiatek, Jens.
"Local Water Dynamics around Antifreeze Protein Residues in the Presence of Osmolytes: The Importance of Hydroxyl and Disaccharide Groups".
The Journal of Physical Chemistry B 118(40)(11613–11621), 2014.
[PDF] (2 MB) [DOI] -
Micciulla, Samantha and Sánchez, Pedro A. and Smiatek, Jens and Qiao, Baofu and Sega, Marcello and Laschewsky, André and Holm, Christian and von Klitzing, Regine.
"Layer-by-Layer Formation of Oligoelectrolyte Multilayers: A Combined Experimental and Computational Study".
Soft Materials 12(sup1)(S14–S21), 2014.
[PDF] (581 KB) [DOI] -
Raafatnia, Shervin and Hickey, Owen A. and Sega, Marcello and Holm, Christian.
"Computing the Electrophoretic Mobility of Large Spherical Colloids by Combining Explicit Ion Simulations with the Standard Electrokinetic Model".
Langmuir 30(7)(1758–1767), 2014.
[PDF] (2 MB) [DOI] -
Raafatnia, Shervin and Hickey, Owen A. and Holm, Christian.
"Mobility Reversal of Polyelectrolyte-Grafted Colloids in Monovalent Salt Solutions".
Physical Review Letters 113(238301), 2014.
[PDF] (336 KB) [DOI] [URL] -
Sega, Marcello and Kantorovich, Sofia S. and Holm, Christian and Arnold, Axel.
"Communication: Kinetic and pairing contributions in the dielectric spectra of electrolyte solutions".
The Journal of Chemical Physics 140(21)(211101), 2014.
[PDF] (2 MB) [DOI] -
Jens Smiatek and Andreas Wohlfarth and Christian Holm.
"The solvation and ion condensation properties for sulfonated polyelectrolytes in different solvents-a computational study".
New Journal of Physics 16(2)(025001), 2014.
[PDF] (742 KB) [DOI] [URL] -
Smiatek, Jens and Heuer, Andreas.
"Deprotonation mechanism of a single-stranded DNA i-motif".
RSC Advances 4(17110–17113), 2014.
[PDF] (380 KB) [DOI] -
Vagias, Apostolos and Košovan, Peter and Koynov, Kaloian and Holm, Christian and Butt, Hans-Jürgen and Fytas, George.
"Dynamics in Stimuli-Responsive Poly(N-isopropylacrylamide) Hydrogel Layers As Revealed by Fluorescence Correlation Spectroscopy".
Macromolecules 47(15)(5303–5312), 2014.
[PDF] (2 MB) [DOI] [URL]
2013
-
Axel Arnold and Olaf Lenz and Stefan Kesselheim and Rudolf Weeber and Florian Fahrenberger and Dominic Röhm and Peter Košovan and Christian Holm.
"ESPResSo 3.1 – Molecular Dynamics Software for Coarse-Grained Models".
In Meshfree Methods for Partial Differential Equations VI, volume 89 of Lecture Notes in Computational Science and Engineering, pages 1–23. Editors: M. Griebel and M. A. Schweitzer,
Springer Berlin Heidelberg, 2013.
[PDF] (380 KB) [DOI] -
Arnold, Axel and Fahrenberger, Florian and Holm, Christian and Lenz, Olaf and Bolten, Matthias and Dachsel, Holger and Halver, Rene and Kabadshow, Ivo and Gähler, Franz and Heber, Frederik and Iseringhausen, Julian and Hofmann, Michael and Pippig, Michael and Potts, Daniel and Sutmann, Godehard.
"Comparison of scalable fast methods for long-range interactions".
Physical Review E 88(063308), 2013.
[PDF] (3 MB) [DOI] -
Arnold, Axel and Breitsprecher, Konrad and Fahrenberger, Florian and Kesselheim, Stefan and Lenz, Olaf and Holm, Christian.
"Efficient Algorithms for Electrostatic Interactions Including Dielectric Contrasts".
Entropy 15(11)(4569–4588), 2013.
[PDF] (3 MB) [DOI] [URL] -
Chakrabarti, Rajarshi and Kesselheim, Stefan and Košovan, Peter and Holm, Christian.
"Tracer diffusion in a crowded cylindrical channel".
Physical Review E 87(6)(062709), 2013.
[PDF] (906 KB) [DOI] -
Dommert, Florian and Holm, Christian.
"Refining classical force fields for ionic liquids: theory and application to [MMIm][Cl]".
Physical Chemistry Chemical Physics 15(6)(2037–2049), 2013.
[PDF] (4 MB) [DOI] -
Owen A. Hickey and Christian Holm.
"Electrophoretic mobility reversal of polyampholytes induced by strong electric fields or confinement".
The Journal of Chemical Physics 138(19)(194905), 2013.
[PDF] (839 KB) [DOI] -
Höpfner, Johannes and Richter, Tobias and Košovan, Peter and Holm, Christian and Wilhelm, Manfred.
"Seawater Desalination via Hydrogels: Practical Realisation and First Coarse Grained Simulations".
In Intelligent Hydrogels, volume 140 of Progress in Colloid and Polymer Science, pages 247–263. Editors: Sadowski, Gabriele and Richtering, Walter,
Springer International Publishing, 2013.
[PDF] (2 MB) [DOI] [URL] -
Klinkigt, Marco and Weeber, Rudolf and Kantorovich, Sofia and Holm, Christian.
"Cluster formation in systems of shifted-dipole particles".
Soft Matter 9(3535–3546), 2013.
[PDF] (893 KB) [DOI] -
Košovan, Peter and Richter, Tobias and Holm, Christian.
"Molecular Simulations of Hydrogels".
In Intelligent Hydrogels, volume 140 of Progress in Colloid and Polymer Science, pages 205–221. Editors: Sadowski, Gabriele and Richtering, Walter,
Springer International Publishing, 2013.
[PDF] (650 KB) [DOI] [URL] -
Samin, Sela and Tsori, Yoav and Holm, Christian.
"Vapor-liquid coexistence of the Stockmayer fluid in nonuniform external fields".
Physical Review E 87(5), 2013.
[PDF] (301 KB) [DOI] -
Sánchez, Pedro A. and Cerdà, Joan J. and Sintes, Tomás and Holm, Christian.
"Effects of the dipolar interaction on the equilibrium morphologies of a single supramolecular magnetic filament in bulk".
The Journal of Chemical Physics 139(4), 2013.
[PDF] (2 MB) [DOI] -
Sega, Marcello and Kantorovich, Sofia S. and Arnold, Axel and Holm, Christian.
"On the Calculation of the Dielectric Properties of Liquid Ionic Systems".
In Recent Advances in Broadband Dielectric Spectroscopy, volume of NATO Science for Peace and Security Series B: Physics and Biophysics, pages 103–122. Editors: Kalmykov, Yuri P.,
Springer Netherlands, 2013.
[PDF] (903 KB) [DOI] -
Semenov, Ilya and Raafatnia, Shervin and Sega, Marcello and Lobaskin, Vladimir and Holm, Christian and Kremer, Friedrich.
"Electrophoretic mobility and charge inversion of a colloidal particle studied by single-colloid electrophoresis and molecular dynamics simulations".
Physical Review E 87(022302), 2013.
[PDF] (2 MB) [DOI] -
Vagias, Apostolos and Raccis, Riccardo and Koynov, Kaloian and Jonas, Ulrich and Butt, Hans-Jürgen and Fytas, George and Košovan, Peter and Lenz, Olaf and Holm, Christian.
"Complex Tracer Diffusion Dynamics in Polymer Solutions".
Physical Review Letters 111(8)(088301), 2013.
[PDF] (492 KB) [DOI] [URL] -
Vagias, Apostolos and Košovan, Peter and Holm, Christian and Butt, Hans-Jürgen and Koynov, Kaloian and Fytas, George.
"Tracer Mobility in Aqueous Poly(N-isopropylacrylamide) Grafted Networks: Effect of Interactions and Permanent Crosslinks".
In Intelligent Hydrogels, volume 140 of Progress in Colloid and Polymer Science, pages 53–62. Editors: Sadowski, Gabriele and Richtering, Walter,
Springer International Publishing, 2013.
[PDF] (429 KB) [DOI] [URL] -
Weeber, Rudolf and Klinkigt, Marco and Kantorovich, Sofia and Holm, Christian.
"Microstructure and magnetic properties of magnetic fluids consisting of shifted dipole particles under the influence of an external magnetic field".
The Journal of Chemical Physics 139(21)(214901), 2013.
[PDF] (2 MB) [DOI] [URL]
2012
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Bachthaler, Sven and Sadlo, Filip and Weeber, Rudolf and Kantorovich, Sofia and Holm, Christian and Weiskopf, Daniel.
"Magnetic Flux Topology of 2D Point Dipoles".
Computer Graphics Forum 31(3, Part 1)(955–964), 2012.
[PDF] (3 MB) [DOI] -
Delle Site, Luigi and Holm, Christian and van der Vegt, Nico F. A..
"Multiscale Approaches and Perspectives to Modeling Aqueous Electrolytes and Polyelectrolytes".
In unknown booktitle, volume 307 of Topics in Current Chemistry, pages 251–294. Editors: B. Kirchner and J. Vrabec,
Springer-Verlag, 2012.
[PDF] (2 MB) [DOI] -
Cerdà, Juan J. and Holm, Christian and Qiao, Baofu.
"Modeling the Structure and Dynamics of Polyelectrolyte Multilayers".
In Ionic Interactions in Natural and Synthetic Macromolecules, chapter 5, pages 121–166. Editors: Ciferri, Alberto and Perico, Angelo,
John Wiley & Sons, Inc., 2012.
[PDF] (2 MB) [DOI] -
Weeber, Rudolf and Kantorovich, Sofia and Holm, Christian.
"Deformation mechanisms in 2D magnetic gels studied by computer simulations".
Soft Matter 8(9923–9932), 2012.
[PDF] (2 MB) [DOI] -
Florian Dommert and Katharina Wendler and Robert Berger and Luigi Delle Site and Christian Holm.
"Force Fields for Studying the Structure and Dynamics of Ionic Liquids: A Critical Review of Recent Developments".
ChemPhysChem 13(7)(1625–1637), 2012.
[PDF] (691 KB) [DOI] -
Wendler, Katharina and Dommert, Florian and Zhao, Yuan Yuan and Berger, Robert and Holm, Christian and Delle Site, Luigi.
"Ionic liquids studied across different scales: A computational perspective".
Faraday Discussions 154(111–132), 2012.
[PDF] (493 KB) [DOI] -
Vincent Ballenegger and Joan J. Cerdà and Christian Holm.
"How to Convert SPME to P3M: Influence Functions and Error Estimates".
Journal of Chemical Theory and Computation 8(3)(936–947), 2012.
[PDF] (489 KB) [DOI] [URL]
2011
-
Baofu Qiao and Marcello Sega and Christian Holm.
"An atomistic study of a poly(styrene sulfonate)/poly(diallyldimethylammonium) bilayer: the role of surface properties and charge reversal".
Physical Chemistry Chemical Physics 13(16336–16342), 2011.
[PDF] (5 MB) [DOI] -
Baofu Qiao and Juan J. Cerdà and Christian Holm.
"Atomistic Study of Surface Effects on Polyelectrolyte Adsorption: Case Study of a Poly(styrenesulfonate) Monolayer".
Macromolecules 44(6)(1707–1718), 2011.
[PDF] (4 MB) [DOI] -
Christian Holm and Nadezhda Gribova and Axel Arnold and Tanja Schilling.
"How close to two dimensions does a Lennard-Jones system need to be to produce a hexatic phase?".
The Journal of Chemical Physics 135(054514), 2011.
[PDF] (419 KB) [DOI] -
Bernward A. Mann and Olaf Lenz and Kurt Kremer and Christian Holm.
"Hydrogels in Poor Solvents: A Molecular Dynamics Study".
Macromolecular Theory and Simulations 20(721–734), 2011.
Cover Issue
[PDF] (2 MB) [DOI] -
Owen A. Hickey and Christian Holm and James L. Harden and Gary W. Slater.
"Influence of Charged Polymer Coatings on Electro-Osmotic Flow: Molecular Dynamics Simulations".
Macromolecules 44(9455–9463), 2011.
[PDF] (2 MB) [DOI] -
Katharina Wendler and Stefan Zahn and Florian Dommert and Robert Berger and Christian Holm and Barbara Kirchner and Luigi Delle Site.
"Locality and Fluctuations: Trends in Imidazolium-Based Ionic Liquids and Beyond".
Journal of Chemical Theory and Computation 7(10)(3040–3044), 2011.
[PDF] (2 MB) [DOI] -
Sofia Kantorovich and Rudolf Weeber and Juan J. Cerdà and Christian Holm.
"Magnetic particles with shifted dipoles".
JMMM 323(10)(1269–1272), 2011.
[PDF] (401 KB) [DOI] -
Juan J. Cerdà and Christian Holm and Kurt Kremer.
"Novel Simulation Approaches for Polymeric and Soft Matter Systems".
Macromolecular Theory and Simulations 20(444–445), 2011.
[PDF] (88 KB) [DOI] -
Juan J. Cerdà and Vincent Ballenegger and Christian Holm.
"Particle-particle particle-mesh method for dipolar interactions: On error estimates and efficiency of schemes with analytical differentiation and mesh interlacing".
The Journal of Chemical Physics 135(184110), 2011.
[PDF] (627 KB) [DOI] -
Marco Klinkigt and Rudolf Weeber and Sofia Kantorovich and Christian Holm.
"System of particles with shifted magnetic dipoles".
Magnetohydrodynamics 47(143–148), 2011.
[PDF] (400 KB) -
Fatemeh Tabatabaei and Olaf Lenz and Christian Holm.
"Simulational study of anomalous tracer diffusion in hydrogels".
Colloid and Polymer Science 289(523–534), 2011.
[PDF] (449 KB) [DOI] [URL] -
Pedro A. Sánchez and Juan J. Cerdà and Vincent Ballenegger and Tomas Sintes and Oreste Piro and Christian Holm.
"Semiflexible magnetic filaments near attractive flat surfaces: a Langevin dynamics study".
Soft Matter 7(5)(1809–1818), 2011.
[PDF] (648 KB) [DOI] -
Elena Pyanzina and Sofia Kantorovich and Juan J. Cerdà and Christian Holm.
"Structure factor of ferrofluids with chain aggregates: Theory and computer simulations".
Journal of Magnetism and Magnetic Materials 323(10)(1263–1268), 2011.
[PDF] (450 KB) [DOI] -
Taisia Prokopyeva and Victor Danilov and Alla Dobroserdova and Sofia Kantorovich and Christian Holm.
"Ground state structures in ferrofluid monolayers".
Journal of Magnetism and Magnetic Materials 323(10)(1298–1301), 2011.
[PDF] (459 KB) [DOI] -
Stefan Kesselheim and Marcello Sega and Christian Holm.
"Applying ICC* to DNA translocation. Effect of dielectric boundaries".
Computer Physics Communications 182(1)(33–35), 2011.
[PDF] (197 KB) -
Sofia Kantorovich and Rudolf Weeber and Juan J. Cerdà and Christian Holm.
"Ferrofluids with shifted dipoles: ground state structures".
Soft Matter 7(11)(5217–5227), 2011.
[PDF] (518 KB) [DOI] -
Juan J. Cerda and Ekaterina Elfimova and Vincent Ballenegger and Ekaterina Krutikova and Alexey Ivanov and Christian Holm.
"Study of the structure factor anisotropy and long range correlations of ferrofluids in the dilute low-coupling regime".
Journal of Magnetism and Magnetic Materials 323(10)(1246–1253), 2011.
[PDF] (431 KB) [DOI] -
Vincent Ballenegger and Joan J. Cerdà and Christian Holm.
"Removal of spurious self-interactions in particle-mesh methods".
Computer Physics Communications 182(9)(1919–1923), 2011.
[PDF] (208 KB) [DOI] [URL]
2010
-
Alexey Neelov and Christian Holm.
"Interlaced P3M algorithm with analytical and ik-differentiation".
The Journal of Chemical Physics 132(23)(234103), 2010.
[PDF] (337 KB) [DOI] -
Kai Grass and Christian Holm.
"Mesoscale modelling of polyelectrolyte electrophoresis".
Faraday Discussions 144(57–70), 2010.
[PDF] (984 KB) [DOI] -
Christian Krekeler and Florian Dommert and Jochen Schmidt and Yuan Yuan Zhao and Christian Holm and Robert Berger and Luigi Delle Site.
"Electrostatic properties of liquid 1,3-dimethylimidazolium chloride: role of local polarization and effect of the bulk.".
Physical Chemistry Chemical Physics 12(8)(1817–1821), 2010.
[PDF] (822 KB) [DOI] -
Sandeep Tyagi and Mehmet Süzen and Marcello Sega and Marcia C. Barbosa and Sofia S. Kantorovich and Christian Holm.
"An iterative, fast, linear-scaling method for computing induced charges on arbitrary dielectric boundaries".
The Journal of Chemical Physics 132(154112), 2010.
[PDF] (267 KB) [DOI] -
Jochen Schmidt and Christian Krekeler and Florian Dommert and Yuanyuan Zhao and Robert Berger and Luigi Delle Site and Christian Holm.
"Ionic Charge Reduction and Atomic Partial Charges from First-Principles Calculations of 1,3-Dimethylimidazolium Chloride".
The Journal of Physical Chemistry B 114(18)(6150–6155), 2010.
[PDF] (345 KB) [DOI] -
Florian Dommert and Jochen Schmidt and Christian Krekeler and Yuan Yuan Zhao and Robert Berger and Luigi Delle Site and Christian Holm.
"Towards multiscale modeling of ionic liquids: From electronic structure to bulk properties".
Journal of Molecular Liquids 152(2–8), 2010.
[PDF] (990 KB) [DOI] -
Han Wang and Florian Dommert and Christian Holm.
"Optimizing working parameters of the smooth particle mesh Ewald algorithm in terms of accuracy and efficiency".
The Journal of Chemical Physics 133(3)(034117), 2010.
[PDF] (281 KB) [DOI] -
Mehmet Sayar and Christian Holm.
"Equilibrium polyelectrolyte bundles with different multivalent counterion concentrations".
Physical Review E 82(3)(031901), 2010.
[PDF] (374 KB) [DOI] -
Baofu Qiao and Juan J. Cerdà and Christian Holm.
"Poly(styrenesulfonate)-Poly(diallyldimethylammonium) Mixtures: Toward the Understanding of Polyelectrolyte Complexes and Multilayers via Atomistic Simulations".
Macromolecules 43(18)(7828–7838), 2010.
[PDF] (3 MB) [DOI] -
Owen A. Hickey and Christian Holm and James L. Harden and Gary W. Slater.
"Implicit Method for Simulating Electrohydrodynamics of Polyelectrolytes".
Physical Review Letters 105(14)(148301), 2010.
[PDF] (204 KB) [DOI] -
Juan J. Cerdà and Ekaterina Elfimova and Vincent Ballenegger and Ekaterina Krutikova and Alexey Ivanov and Christian Holm.
"Behavior of bulky ferrofluids in the diluted low-coupling regime: Theory and simulation".
Physical Review E 81(011501), 2010.
[PDF] (375 KB) [DOI]
2009
-
Mehmet Süzen and Marcello Sega and Christian Holm.
"Ensemble inequivalence in single-molecule-experiments".
Physical Review E 79(051118), 2009.
[PDF] (269 KB) [DOI] -
Taisia Prokopieva and Victor Danilov and Sofia Kantorovich and Christian Holm.
"Ground state structures in ferrofluid monolayers".
Physical Review E 80(3)(031404), 2009.
[PDF] (616 KB) [DOI] -
Smiatek, Jens and Sega, Marcello and Holm, Christian and Schiller, Ulf D. and Schmid, Friederike.
"Mesoscopic simulations of the counterion-induced electro-osmotic flow: A comparative study".
The Journal of Chemical Physics 130(244702), 2009.
[PDF] (370 KB) [DOI] -
Gil C. Claudio and Kurt Kremer and Christian Holm.
"Comparison of a hydrogel model to the Poisson-Boltzmann cell model".
The Journal of Chemical Physics 131(9)(094903), 2009.
[PDF] (453 KB) [DOI] -
Juan J. Cerdà and Baofu Qiao and Christian Holm.
"Understanding polyelectrolyte multilayers: an open challenge for simulations".
Soft Matter 5(4412–4425), 2009.
[PDF] (2 MB) [DOI] -
Juan J. Cerdà and Baofu Qiao and Christian Holm.
"Modeling strategies for polyelectrolyte multilayers".
European Journal of Physics Special Topics 177(1)(129–148), 2009.
[PDF] (971 KB) [DOI] -
Kai Grass and Christian Holm.
"Polyelectrolytes in electric fields: Measuring the dynamical effective charge and effective friction".
Soft Matter 5(2079–2092), 2009.
[PDF] (4 MB) [DOI] -
Kai Grass and Christian Holm and Gary W. Slater.
"Optimizing end-labeled free-solution electrophoresis by increasing the hydrodynamic friction of the drag labels".
Macromolecules 42(14)(5352–5359), 2009.
http://arxiv.org/abs/0902.1889
[DOI]
2008
-
Juan J. Cerdà and Vincent Ballenegger and Olaf Lenz and Christian Holm.
"P3M algorithm for dipolar interactions.".
The Journal of Chemical Physics 129(234104), 2008.
[PDF] (516 KB) [Preprint] [DOI] -
Juan J. Cerdà and Tomás Sintes and C. Holm and C. M. Sorensen and A. Chakrabarti.
"Shear effects on crystal nucleation in colloidal suspensions".
Physical Review E 78(031403), 2008.
[PDF] (1001 KB) [DOI] -
Juan J. Cerdà and Sofia Kantorovich and Christian Holm.
"Aggregate formation in ferrofluid monolayers: simulations and theory".
Journal of Physics: Condensed Matter 20(204125), 2008.
[PDF] (342 KB) [DOI] -
Kai Grass and Ute Böhme and Ulrich Scheler and Hervé Cottet and Christian Holm.
"Importance of Hydrodynamic Shielding for the Dynamic Behavior of Short Polyelectrolyte Chains".
Physical Review Letters 100(096104), 2008.
[PDF] (115 KB) [DOI] -
Baofu Qiao and Christian Krekeler and Robert Berger and Luigi Delle Site and Christian Holm.
"Effect of Anions on Static Orientational Correlations, Hydrogen Bonds, and Dynamics in Ionic Liquids: A Simulational Study".
The Journal of Physical Chemistry B 112(6)(1743–1751), 2008.
[PDF] (361 KB) [DOI] -
Sofia Kantorovich and Juan J. Cerdà and Christian Holm.
"Microstructure analyisis of monodisperse ferrofluid monolayers: theory and simulation".
Physical Chemistry Chemical Physics 10(14)(1883–1895), 2008.
[PDF] (2 MB) [DOI] -
Olaf Lenz and Christian Holm.
"Simulation of charge reversal in salty environments: Giant overcharging?".
European Physical Journal E 26(191–195), 2008.
[PDF] (309 KB) [Preprint] [DOI] -
Vincent Ballenegger and Joan J. Cerdà and Olaf Lenz and Christian Holm.
"The optimal P3M algorithm for computing electrostatic energies in periodic systems".
The Journal of Chemical Physics 128(3)(034109), 2008.
[PDF] (426 KB) [Preprint] [DOI] -
Sandeep Tyagi and Axel Arnold and Christian Holm.
"Electrostatic layer correction with image charges: A linear scaling method to treat slab 2D + h systems with dielectric interfaces".
The Journal of Chemical Physics 129(20)(204102), 2008.
[PDF] (222 KB) [DOI]
2007
-
Sandeep Tyagi and Axel Arnold and Christian Holm.
"ICMMM2D: An accurate method to include planar dielectric interfaces via image charge summation".
The Journal of Chemical Physics 127(154723), 2007.
[PDF] (305 KB) [DOI] -
Ivanov, Alexey O. and Kantorovich, Sofia S. and Reznikov, Evgeniy N. and Holm, Christian and Pshenichnikov, Alexander F. and Lebedev, Alexander V. and Chremos, Alexandros and Camp, Philip J..
"Magnetic properties of polydisperse ferrofluids: A critical comparison between experiment, theory and computer simulation".
Physical Review E 75(061405), 2007.
[PDF] (339 KB) [DOI] -
Vladimir Lobaskin and Burkhard Dünweg and Martin Medebach and Thomas Palberg and Christian Holm.
"Electrophoresis of Colloidal Dispersions in the Low-Salt Regime".
Physical Review Letters 98(176105), 2007.
[PDF] (169 KB) [DOI] -
Dmytro Antypov and Christian Holm.
"Osmotic Coefficient Calculations for Dilute Solutions of Short Stiff-Chain Polyelectrolytes".
Macromolecules 40(3)(731–738), 2007.
[PDF] (182 KB) [DOI] -
Berk Hess and Mehmet Sayar and Christian Holm.
"Stability of Hydrophobically Modified Poly(\it p-phenylene)sulfonate Bundles as Observed by Molecular Dynamics Simulation".
Macromolecules , 2007.
[PDF] (239 KB) -
M. Sayar and C. Holm.
"Finite Size Polyelectrolyte Bundles at Thermodynamic Equilibrium".
Europhysics Letters 77(16001), 2007.
[PDF] (328 KB) [Preprint] [DOI]
2006
-
Christian Holm and Alexey Ivanov and Sofia Kantorovich and Elena Pyanzina and Evgeniy Reznikov.
"Equilibrium properties of a bidisperse ferrofluid with chain aggregates: theory and computer simulations".
Journal of Physics: Condensed Matter 18(38)(S2737–S2756), 2006.
[PDF] (2 MB) [DOI] -
Christian Holm and Alexey Ivanov and Sofia Kantorovich and Elena Pyanzina.
"Polydispersity influence upon magnetic properties of aggregated ferrofluids".
Zeitschrift für Physikalische Chemie 220(105–115), 2006.
[PDF] (261 KB) [DOI] -
Dmytro Antypov and Christan Holm.
"Optimal cell approach to osmotic properties of finite stiff-chain polyelectrolytes".
Physical Review Letters 96(088302), 2006.
[PDF] (163 KB) [DOI] -
Axel Arnold and Bernward A. Mann and Christian Holm.
"Simulating Charged Systems with ESPResSo".
In Computer Simulations in Condensed Matter: from Materials to Chemical Biology, volume of Lecture Notes in Physics, pages 193–222. Editors: M. Ferrario and G. Ciccotti and K. Binder,
Springer, Berlin, Germany, 2006.
[PDF] (2 MB) [DOI] -
Hess, Berk and Holm, Christian and van der Vegt, Nico.
"Modeling multi-body effects in ionic solutions with a concentration dependent dielectric permittivity".
Physical Review Letters 96(147801), 2006.
[PDF] (115 KB) [DOI] -
Hess, Berk and Holm, Christian and van der Vegt, Nico.
"Osmotic Coeffcients of atomistic NaCl (aq) force-fields".
The Journal of Chemical Physics 124(164509), 2006.
[PDF] (354 KB) [DOI] -
Hans Jörg Limbach and Axel Arnold and B. A. Mann and Christian Holm.
"ESPResSo – An Extensible Simulation Package for Research on Soft Matter Systems".
Computer Physics Communications 174(9)(704–727), 2006.
[PDF] (318 KB) [DOI] -
Bernward Mann and Christian Holm and Kurt Kremer.
"The Swelling Behaviour of Charged Hydrogels".
Macromolecular Symposia 237(90–107), 2006.
[PDF] (563 KB) [DOI] -
Frank Mühlbacher and Christian Holm and Helmut Schiessel.
"Controlled DNA compaction within chromatin: The tail-bridging effect".
Europhysics Letters 73(1)(135–141), 2006.
[PDF] (273 KB) [DOI] -
Frank Mühlbacher and Helmut Schiessel and Christian Holm.
"Tail-induced attraction between nucleosome core particles".
Physical Review E 74(031919), 2006.
[PDF] (811 KB) [DOI] -
Stukan, Mikhail R. and Lobaskin, Vladimir A. and Holm, Christian and Vinogradova, Olga I..
"Spatial distribution of polyelectrolyte and counterions in nanocapsules: A computer simulation study".
Physical Review E 73(021801), 2006.
[PDF] (616 KB) [DOI]
2005
-
Dmytro Antypov and Marcia C. Barbosa and Christian Holm.
"A simple non-local approach to treat size correlations within Poisson-Boltzmann theory".
Physical Review E 71(061106), 2005.
[PDF] (138 KB) -
Axel Arnold and Christian Holm.
"Efficient methods to compute long range interactions for soft matter systems".
In Advanced Computer Simulation Approaches for Soft Matter Sciences II, volume of Advances in Polymer Science, pages 59–109. Editors: C. Holm and K. Kremer,
Springer, Berlin, 2005.
[PDF] (2 MB) [DOI] -
Axel Arnold and Christian Holm.
"MMM1D: A method for calculating electrostatic interactions in 1D periodic geometries".
The Journal of Chemical Physics 123(12)(144103), 2005.
[PDF] (122 KB) [DOI] -
Christian Holm.
"The Physics of Overcharging".
Traffic and Granular Flow '03 , pages 475–488, Editors: S. P. Hoogendoorn and S. Luding and P. H. L. Bovy and M. Schreckenberg and D. E. Wolf, , 2005.
Springer Berlin Heidelberg.
[PDF] (166 KB) [DOI] -
Holm, Christian and Weis, Jean-Jacque.
"The Structure of Ferrofluids: A Status Report".
Current Opinion in Colloid & Interface Science 10(3)(133–140), 2005.
[PDF] (166 KB) [DOI] -
J. P. Huang and Z. W. Wang and C. Holm.
"Computer simulations of the structure of colloidal ferrofluids.".
Physical Review E 71(6 Pt 1)(061203), 2005.
[PDF] (2 MB) [DOI] -
J. P. Huang and Z. Wang and C. Holm.
"Structure and magnetic properties of mono- and bi- dispersed ferrofluids as revealed by simulations".
Journal of Magnetism and Magnetic Materials 289(234), 2005.
[PDF] (113 KB) [DOI] -
Hans Jörg Limbach and Kurt Kremer and Christian Holm.
"Computer Simulations of the ``Hairy Rod'' model".
Macromolecular Chemistry and Physics 206(77–82), 2005.
[PDF] (209 KB) [DOI] -
Bernward A. Mann and Christian Holm and Kurt Kremer.
"Swelling of Polyelectrolyte Networks".
The Journal of Chemical Physics 122(15)(154903), 2005.
[PDF] (811 KB) [DOI]
2004
-
Marcia C. Barbosa and Markus Deserno and Christian Holm and René Messina.
"Screening of spherical colloids beyond mean field: A local density functional approach".
Physical Review E 69(051401), 2004.
[PDF] (121 KB) [DOI] -
Christian Holm.
"Efficient methods for long range interactions in periodic geometries plus one application".
In Computational Soft Matter: From Synthetic Polymers to Proteins, volume 23 of NIC series, pages 195–236. Editors: N. Attig and K. Binder and H. Grubmüller and K. Kremer,
Research Centre Jülich, 2004.
[PDF] (630 KB) -
Christian Holm and Matthias Rehahn and Wilhelm Oppermann and Matthias Ballauff.
"Stiff-Chain Polyelectrolytes".
In Polyelectrolytes with Defined Molecular Architecture II, volume 166 of Advances in Polymer Science, pages 1–27. Editors: Schmidt, Manfred,
Springer Berlin Heidelberg, 2004.
[PDF] (530 KB) [DOI] -
Holm, Christian and Joanny, Jean-Fran\ccois and Kremer, Kurt and Netz, Roland R. and Reineker, Peter and Seidel, Christian and Vilgis, Thomas A. and Winkler, Roland G..
"Polyelectrolyte Theory".
In Polyelectrolytes with Defined Molecular Architecture II, volume 166 of Advances in Polymer Science, pages 67–111. Editors: Schmidt, Manfred,
Springer Berlin Heidelberg, New York, 2004.
[PDF] (935 KB) [DOI] -
J. P. Huang and Christian Holm.
"Magnetization of polydisperse colloidal ferrofluids: Effect of magnetostriction".
Physical Review E 70(061404), 2004.
[PDF] (101 KB) [DOI] -
Ivanov, Alexey O. and Wang, Zuowei and Holm, Christian.
"Applying the Chain Formation Model to magnetic properties of aggregated ferrofluids".
Physical Review E 69(031206), 2004.
[PDF] (102 KB) [DOI] -
Hans Jörg Limbach and Mehmet Sayar and Christian Holm.
"Polyelectrolyte Bundles".
Journal of Physics: Condensed Matter 16(22)(2135–2144), 2004.
[PDF] (262 KB) [Preprint] [DOI] -
Hans Jörg Limbach and Christian Holm.
"Conformations and Solution Structure of Polyelectrolytes in Poor Solvent".
Polyelectrolytes , volume 9 of Dresdener Polymer Discussions 2003Editors: U. Scheler, , Dresden, Germany, 2004.
Wiley-VCH, Weinheim.
[DOI] -
Vladimir Lobaskin and Burkhard Dünweg and Christian Holm.
"Electrophoretic mobility of a charged colloidal particle: A computer simulation study".
Journal of Physics: Condensed Matter 16(38)(S4063–S4073), 2004.
[PDF] (312 KB) [Preprint] [DOI] -
Bernward A. Mann and Ralf Everaers and Christian Holm and Kurt Kremer.
"Scaling in polyelectrolyte networks".
Europhysics Letters 67(5)(786–792), 2004.
[PDF] (261 KB) [DOI] -
R. Messina.
"Effect of image forces on polyelectrolyte adsorption at a charged surface".
Physical Review E 70(5)(051802), 2004.
[PDF] (620 KB) -
Ali Naji and Axel Arnold and Christian Holm and Roland R. Netz.
"Attraction and unbinding of like–charged rods".
Europhysics Letters 67(130–136), 2004.
[PDF] (142 KB) [DOI]
2003
-
Holm, Christian and Limbach, Hans Jörg and Kremer, Kurt.
"Poor-solvent polyelectrolytes".
Journal of Physics: Condensed Matter 15(1)(S205–S211), 2003.
[PDF] (262 KB) [DOI] -
Jiménez-Ángeles, Felipe and Messina, René and Holm, Christian and Lozada-Cassou, Marcelo.
"Ion pairing in model electrolytes: A study via three-particle correlation functions".
The Journal of Chemical Physics 119(9)(4842-4856), 2003.
[PDF] (522 KB) [Preprint] [DOI] -
Hans Jörg Limbach and Christian Holm.
"Single-Chain Properties of Polyelectrolytes in Poor Solvent".
Journal of Physical Chemistry B 107(32)(8041–8055), 2003.
[PDF] (403 KB) [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Polyelectrolyte Multilayering in Spherical Geometry".
Langmuir 19(4473–4482), 2003.
[PDF] (963 KB) [Preprint] -
Zuowei Wang and Christian Holm and Hanns Walter Müller.
"Boundary condition effects in the simulation study of equilibrium properties of magnetic dipolar fluids".
The Journal of Chemical Physics 119(379), 2003.
[PDF] (175 KB) [DOI] -
Zuowei Wang and Christian Holm and Hanns Walter Müller.
"Computer simulation study of equilibrium properties of magnetic dipolar fluids".
Magnetohydrodynamics 39(1)(59–64), 2003.
-
Zuowei Wang and Christian Holm.
"Structure and magnetization properties of polydispersed ferrofluids: A molecular dynamics study".
Physical Review E 68(041401), 2003.
[PDF] (419 KB)
2002
-
Axel Arnold and Christian Holm.
"MMM2D: A fast and accurate summation method for electrostatic interactions in 2D slab geometries".
Computer Physics Communications 148(3)(327–348), 2002.
[PDF] (3 MB) [Preprint] [DOI] -
Axel Arnold and Christian Holm.
"A novel method for calculating electrostatic interactions in 2D periodic slab geometries".
Chemical Physics Letters 354(324–330), 2002.
[PDF] (425 KB) [DOI] -
Arnold, Axel and de Joannis, Jason and Holm, Christian.
"Electrostatics in Periodic Slab Geometries I".
The Journal of Chemical Physics 117(2496–2502), 2002.
[PDF] (217 KB) [Preprint] [DOI] -
Arnold, Axel and de Joannis, Jason and Holm, Christian.
"Electrostatics in Periodic Slab Geometries II".
The Journal of Chemical Physics 117(2503–2512), 2002.
[PDF] (267 KB) [Preprint] [DOI] -
Jason de Joannis and Axel Arnold and Christian Holm.
"Electrostatics in Periodic Slab Geometries II".
The Journal of Chemical Physics 117(2503–2512), 2002.
[PDF] (318 KB) [DOI] -
Markus Deserno and Christian Holm.
"Theory and simulations of rigid polyelectrolytes".
Molecular Physics 100(18)(2941–2956), 2002.
[Preprint] [DOI] -
Holm, Christian and Kremer, Kurt and Deserno, Markus and Limbach, Hans Jörg.
"Computer Modeling of Charged Polymers".
In NIC Symposium 2001, volume 9 of NIC Series, Vol. 9, pages 385–395. Editors: H. Rollnik and D. Wolf,
John von Neumann Institute for Computing, Jülich, Germany, 2002.
[PDF] (668 KB) -
Hans Jörg Limbach and Christian Holm.
"Conformational properties of poor solvent polyelectrolytes".
Computer Physics Communications 147(321–324), 2002.
[Preprint] [DOI] -
Hans Jörg Limbach and Christian Holm and Kurt Kremer.
"Structure of polyelectrolytes in poor solvent".
Europhysics Letters 60(4)(566–572), 2002.
[PDF] (168 KB) [Preprint] [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Conformation of a Polyelectrolyte Complexed to a Like-Charged Colloid".
Physical Review E 65(041805), 2002.
[PDF] (163 KB) [Preprint] [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Like-charge colloid-polyelectrolyte complexation".
The Journal of Chemical Physics 117(2947), 2002.
[Preprint] [DOI] -
Messina, René and González Tovar, Enrique and Lozada-Cassou, Marcelo and Holm, Christian.
"Overcharging: The Crucial Role of Excluded Volume".
Europhysics Letters 60(383–389), 2002.
[PDF] (148 KB) [Preprint] [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Charge inversion in colloidal systems".
Computer Physics Communications 147(282–285), 2002.
[Preprint] [DOI] -
Wang, Zuowei and Holm, Christian and Müller, Hanns Walter.
"Molecular dynamics study on the equilibrium magnetization properties and structure of ferrofluids".
Physical Review E 66(021405), 2002.
[PDF] (849 KB) [Preprint] [DOI]
2001
-
Markus Deserno and Christian Holm and Kurt Kremer.
"Molecular dynamics simulations of the cylindrical cell model".
In Physical Chemistry of Polyelectrolytes, volume 99 of Surfactant science series, chapter 2, pages 59–110. Editors: T. Radeva,
Marcel Decker, New York, 2001.
-
Markus Deserno and Christian Holm and Jürgen Blaul and Matthias Ballauff and Matthias Rehahn.
"The Osmotic Coefficient of Rod-like Polyelectrolytes: Computer Simulation, Analytical Theory, and Experiment".
European Physical Journal E 5(97–103), 2001.
[PDF] (147 KB) [DOI] -
Markus Deserno and Felipe Jiménez-Ángeles and Christian Holm and Marcelo Lozada-Cassou.
"Overcharging of DNA in the presence of salt: Theory and Simulation".
The Journal of Physical Chemistry B 105(44)(10983–10991), 2001.
[PDF] (143 KB) [Preprint] [DOI] -
Markus Deserno and Christian Holm.
"Cell-model and Poisson-Boltzmann-theory: A brief introduction".
In Electrostatic Effects in Soft Matter and Biophysics, volume 46 of NATO Science Series II - Mathematics, Physics and Chemistry, pages 27–50. Editors: C. Holm and P. Kékicheff and R. Podgornik,
Kluwer Academic Publishers, Dordrecht, Nl, 2001.
[PDF] (262 KB) [DOI] -
Christian Holm and Kurt Kremer.
"Computer Simulations of Charged Systems".
In Electrostatic Effects in Soft Matter and Biophysics, volume 46 of NATO Science Series II - Mathematics, Physics and Chemistry. Editors: C. Holm and P. Kékicheff and R. Podgornik,
Kluwer Academic Publishers, Dordrecht, Nl, 2001.
[DOI] -
Christian Holm.
"What can Ising spins teach us about Quantum Gravity?".
In Fluctuating Paths and Fields, pages 707–720. Editors: A. Pelster and M. Bachmann and W. Janke,
World Scientific, Singapore, 2001.
[DOI] -
Hans Jörg Limbach and Christian Holm.
"End-effects of strongly charged polyelectrolytes - a molecular dynamics study".
The Journal of Chemical Physics 114(21)(9674–9682), 2001.
[DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Effect of colloidal charge discretization in the primitive model".
European Physical Journal E 4(363–370), 2001.
[PDF] (250 KB) [Preprint] [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Strong electrostatic interactions in spherical collidal systems".
Physical Review E 64(021405), 2001.
[PDF] (2 MB) [Preprint] [DOI] -
Wang, Zuowei and Holm, Christian.
"Estimate of the Cutoff Errors in the Ewald Summation for Dipolar Systems".
The Journal of Chemical Physics 115(6351), 2001.
[PDF] (2 MB) [DOI]
2000
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Marcia C. Barbosa and Markus Deserno and Christian Holm.
"A stable local density functional approach to ion-ion correlations".
Europhysics Letters 52(1)(80–86), 2000.
[PDF] (147 KB) [Preprint] [DOI] -
Markus Deserno and Christian Holm and Sylvio May.
"Fraction of Condensed Counterions around a Charged Rod: Comparison of Poisson-Boltzmann Theory and Computer Simulations".
Macromolecules 33(199–206), 2000.
[PDF] (98 KB) [Preprint] [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Strong attraction between charged spheres due to metastable ionized states".
Physical Review Letters 85(872–875), 2000.
[PDF] (155 KB) [DOI] -
René Messina and Christian Holm and Kurt Kremer.
"Ground state of two unlike charged colloids: An anology with ionic bonding".
Europhysics Letters 51(461–467), 2000.
[PDF] (246 KB) [DOI]
1999
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Christian Holm and Kurt Kremer.
"Polyelectrolytes in Solution - Recent Computer Simulations".
Proceedings of Yamada Conference ``Polyelectrolytes'', Inuyama, Japan , pages 27–36, Editors: I. Noda and E. Kokufuta, , Osaka, Japan, 1999.
Yamada Science Foundation.
[PDF] (214 KB) [Preprint] -
Christian Holm and Wolfhard Janke.
"Simplicial Quantum Gravity on a Randomly Triangulated Sphere".
International Journal of Modern Physics A 14(24)(3885–3903), 1999.
[DOI] -
Elmar Bittner and A. Hauke and Harald Markum and J. Riedler and Christian Holm and Wolfhard Janke.
"Lattice Models of 2D-Quantum Gravity".
Proceedings of the Eigth Marcel Grossmann Meeting , pages 769, Editors: Tsvi Piran and Remo Ruffini, , The Hebrew University, Jerusalem, Israel, June 22 - 27, 1997, 1999.
World Scientific Publishers.
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Elmar Bittner and A. Hauke and Christian Holm and Wolfhard Janke and Harald Markum and J. Riedler.
"$Z_2$-Regge versus Standard Regge Calculus in Two Dimensions".
Physical Review D 59(124018), 1999.
[PDF] (208 KB) [DOI] -
Uwe Micka and Christian Holm and Kurt Kremer.
"Strongly Charged, Flexible Polyelectrolytes in Poor Solvents - A Molecular Dynamics Study".
Langmuir 15(12)(4033-4044), 1999.
[PDF] (2 MB) [Preprint] [DOI]
1998 and before
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Christian Holm.
"Anwendung von FFT Ewald Gitter-Methoden in Simulationen von Polyelektrolyten".
In Höchstleistungsrechnen in der Chemie, pages 67–69. Editors: R. Esser and J. Grotendorst and M. Lewerenz,
Research Center Jülich, Jülich, 1998.
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Holm, Christian and Kremer, Kurt and Vilgis, Thomas A..
"Polyelektrolyte: Grundlegende Probleme bei der Beschreibung weitverbreiteter Substanzen".
Physikalische Blätter 54(11)(1013–1016), 1998.
[PDF] (2 MB) [DOI] -
Elmar Bittner and A. Hauke and Christian Holm and Wolfhard Janke and Harald Markum and J. Riedler.
"Standard and $Z_2$-Regge Theory in two Dimensions".
Nuclear Physics B: Proceedings Supplements 63(1)(769-771), 1998.
[PDF] (221 KB) [DOI] -
Elmar Bittner and A. Hauke and Christian Holm and Wolfhard Janke and Harald Markum and J. Riedler.
"Lattice Models of Quantum Gravity".
In Frontiers in Quantum Physics, pages 303. Editors: S. C. Lim and R. Abd-Shukor and K. H. Kwek,
Springer, Berlin, 1998.
[PDF] (117 KB) -
Deserno, Markus and Holm, Christian.
"How to mesh up Ewald sums. I. A theoretical and numerical comparison of various particle mesh routines".
The Journal of Chemical Physics 109(7678), 1998.
[PDF] (307 KB) [DOI] -
Deserno, Markus and Holm, Christian.
"How to mesh up Ewald sums. II. An accurate error estimate for the Particle-Particle-Particle-Mesh algorithm".
The Journal of Chemical Physics 109(7694), 1998.
[PDF] (200 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Critical Exponents of the Classical Heisenberg Ferromagnet".
Physical Review Letters 78(2265), 1997.
FUB-HEP-96-8
[PDF] (53 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Fixed Versus Random Triangulations in 2D Regge Calculus".
Physics Letters B 390(1)(59–63), 1997.
FUB-HEP-96-10
[PDF] (394 KB) [DOI] -
Christian Holm.
"Influence of the Path Integral Measure in Quantum Gravity".
In Functional Integration: Basics and Applications, volume of NATO ASI Series B: Physics Vol. 361, pages 417. Editors: DeWitt-Morette, C. and Cartier, P. and Folacci, A.,
Plenum, New York, 1997.
[DOI] -
Christian Holm and Wolfhard Janke and Tetsuo Matsui and Kazuhiko Sakakibara.
"Monte Carlo Study of Asymmetric 2D XY Model".
Physica A: Statistical Mechanics and its Applications 246(3)(633–645), 1997.
[PDF] (598 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Measuring the String Susceptibility in 2D Simplicial Quantum Gravity Using the Regge Approach".
Nuclear Physics B 477(465–488), 1996.
FUB-HEP 17/95
[PDF] (2 MB) [DOI] -
Christian Holm and Wolfhard Janke.
"Ising Spins on a Gravitating Sphere".
Physics Letters B 375(1)(69–74), 1996.
FUB-HEP 18/95
[PDF] (508 KB) [DOI] -
Christian Holm.
"2D Non-Perturbative Euclidean Quantum Gravity via Regge Calculus".
1996.
unpublished
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Christian Holm and Wolfhard Janke.
"Measure Dependence of 2D Simplicial Quantum Gravity".
Nuclear Physics B: Proceedings Supplements 42(1)(722–724), 1995.
FUB-HEP 20/94
[PDF] (215 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"The Ising Transition in 2D Simplicial Quantum Gravity – Can Regge Calculus be Right?".
Nuclear Physics B: Proceedings Supplements 42(1)(725–727), 1995.
FUB-HEP 19/94
[PDF] (236 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Monte Carlo study of topological defects in the 3D Heisenberg model".
Journal of Physics A: Mathematical and General 27(7)(2553–2563), 1994.
FUB-HEP 10/93
[PDF] (504 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"The critical behaviour of Ising spins on 2D Regge lattices".
Physics Letters B 335(2)(143–150), 1994.
[PDF] (450 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"High Pecision Monte Carlo Determination of $\alpha/\nu$ in the 3D Classical Heisenberg Model".
International Journal of Modern Physics C 5(2)(267–270), 1994.
[DOI] -
Christian Holm and Wolfhard Janke.
"High Precision Single-Cluster MC Measurement of the Critical Exponents of the Classical 3D Heisenberg Model".
Nuclear Physics B: Proceedings Supplements 30(846–849), 1993.
[PDF] (321 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Finite-size scaling study of the three-dimensional classical Heisenberg model".
Physics Letters A 173(1)(8–12), 1993.
[PDF] (354 KB) [DOI] -
Christian Holm and Wolfhard Janke.
"Critical exponents of the classical three-dimensional Heisenberg model: A single-cluster Monte Carlo study".
Physical Review B 48(2)(936–950), 1993.
[PDF] (3 MB) [DOI] -
Joan Adler and Christian Holm and Wolfhard Janke.
"High-Temperature Series Analysis of the Classical Heisenberg and XY Model".
Physica A 201(4)(581–592), 1993.
[PDF] (969 KB) [DOI] -
Holm, Christian and Hennig, Jörg D..
"A Poincaré Gauge Theory on Regge Simplexes".
Classical and Quantum Systems- Foundations and Symmetries, Proceedings of the II. International Wigner Symposium , pages 723–726, Editors: Doebner, H. D. and Scherer, W. and Schroeck, Jr., F., , 1991.
World Scientific.
[PDF] (31 MB) -
Holm, Christian and Hennig, Jörg D..
"Regge Calculus with Torsion".
In Group Theoretical Methods in Physics, volume 382 of Lecture Notes in Physics, pages 556–560. Editors: Dodonov, V. V. and Man'ko, V. I.,
Springer, Berlin, Germany, 1991.
[PDF] (587 KB) [DOI] -
Christian Holm.
"Differential Geometry, Gauge Theories, and Gravity".
1990.
book review
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Christian Holm.
"Connections in Bergmann Manifolds".
International Journal of Theoretical Physics 29(1)(23–36), 1990.
[PDF] (726 KB) [DOI] -
Finkelstein, David and Holm, Christian.
"Neutrino-Neutrino Scattering in Quantum Network Dynamics".
Bulletin of the American Physical Society 34(114), 1989.
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Christian Holm.
"The Hyperspin Structure of Unitary Groups".
Journal of Mathematical Physics 29(4)(978–986), 1988.
[PDF] (2 MB) [DOI] -
Christian Holm.
"Neutrino Spectrum of Einstein Universes".
Journal of Mathematical Physics 29(10)(2273–2279), 1988.
[PDF] (1015 KB) [DOI] -
Christian Holm.
"The Hyperspin Structure of Einstein Universes and Their Neutrino Spectrum".
PhD thesis, Georgia Institute of Technology, 1987.
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Finkelstein, David and Finkelstein, Shlomit Ritz and Holm, Christian.
"Hypergravitational Field Equations".
Physical Review Letters 59(1265–1266), 1987.
[PDF] (95 KB) [DOI] -
Christian Holm.
"Christoffel Formula and Geodesic Motion in Hyperspin Manifolds".
International Journal of Theoretical Physics 25(11)(1209–1213), 1986.
[PDF] (574 KB) [DOI] -
John Eidson and Sarah Flynn and Christian Holm and D. Weeks and Ronald F. Fox.
"Elementary Explanation of Boundary Shading in Chaotic-Attractor Plots for the Feigenbaum Map and the Circle Map".
Physical Review A 33(2809–2812), 1986.
[PDF] (3 MB) [DOI] -
Finkelstein, David and Finkelstein, Shlomit Ritz and Holm, Christian.
"Hyperspin Manifolds".
International Journal of Theoretical Physics 25(4)(441–463), 1986.
[PDF] (4 MB) [DOI] -
Christian Holm.
"Spinors in Discrete Space-Time".
Master's thesis, Georgia Institute of Technology, feb, 1985.