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VI Scaling functions

[72.1.4.1] This section discusses how the general theory above may be used to obtain finite size scaling functions at the critical point.

[72.2.1.1] The finite size scaling function p~Xx,y for the probability density px,ξ,L of the observable X is defined through an equation analogous to (1.3) by

px,L,ξ=LddX-d*/d-d*p~XxLddX-d*/d-d*,L/ξd*(6.1)

where dX is the anomalous dimension of X. [72.2.1.2] The ensemble limit yields explicit analytical expressions for the scaling functions p~Xx,y at the critical point. [72.2.1.3] This is seen from (4.11) as well as from (4.4) which become identical in the ensemble limit if ϖX<2. [72.2.1.4] If X is identified as the macroscopic (thermodynamic) equivalent of the microscopic observable Y then it follows from (4.4) and (4.11) that the finite ensemble scaling functions are given as

p~XESx,y=p~YESx,y=hx;ϖX,ζX,0,D(6.2)

if 1<ϖX<2. [72.2.1.5] The superscript is a reminder for the ensemble limit. [72.2.1.6] The point ϖX=1 corresponding to first order transitions is singular and will not be discussed here. [72.2.1.7] For ϖX=2 on the other hand the thermodynamic form (4.4) yields a simple Gaussian while the fieldtheoretic form (4.11) gives

p~XESx,y=14πDy2dX-dexp-x24Dy2dX-d.(6.3)

[72.2.1.8] This is the scaling function conjectured in [7] for the order parameter density on the basis of a Gaussian approximation. [72.2.1.9] Note that this scaling function, contrary to those for ϖX<2, does depend on the variable y separately. [72.2.1.10] Note also that the order parameter generally has anomalous dimension dΨ<d/2 and thus this scaling form for the order parameter distribution is expected to arise in the vicinity but not directly at the critical point.

[72.2.2.1] Another source for the dependence of the scaling function p~Ψx,y for the order parameter distribution on y is the appearance of the nonuniversal cutoff function R in the finite size scaling limit of equation (3.18). [72.2.2.2] With equation (3.18) and introducing the abbreviations Rx,L/ξ=Rx,,L/ξd,, hx=hx;ϖX,ζX,0,D and Hx=Hx;ϖX,ζX,0,D the analogue of equation (6.2) reads

p~XFSSx,y=Rx,yhx+HxRx,yx    :    for  x0Rx,yhx-1-HxRx,yx    :    for  x>0(6.4)

for the finite size scaling limit. [72.2.2.3] Thus it is seen that the finite ensemble scaling function h corresponds to the universal part of the finite size scaling function which is independent of y while the cutoff function R is responsible [page 73, §0]    for the dependence on y and adds a nonuniversal part.

[73.1.1.1] The analytical expressions (3.5) and (3.12) for the universal part of critical finite size scaling functions can be employed to evaluate the scaling functions numerically. [73.1.1.2] In this effort the symmetry relation [28]

h-x,ϖX,ζX,0,1=hx;ϖX,-ζX,0,1(6.5)

reduces the computational effort. [73.1.1.3] Moreover equation (6.5) suggests a relation with the phenomenon of spontaneous symmetry breaking within the present approach. [73.1.1.4] In this view the two scaling functions hx;ϖX,±ζX,0,1 represent the two pure phases, and thus on general thermodynamic grounds the full scaling function is expected to become a convex combination

p~Xx=p~XESx,y=shx;ϖX,ζX,0,D+1-shx;ϖX,-ζX,0,D(6.6)

of two extremal phases. [73.1.1.5] The relation may be generalized to several phases or asymmetric situations.

Figure 2: Universal part of the finite size scaling functions p~Ψx;3,ζ,1/2 for the order parameter probability density function for the mean field universality class corresponding to δ=3 for the equation of state exponent (or ϖΨ=1+1/δ=4/3). All curves have width D=1, and symmetrization s=1/2. Different curves correspond to different choices of the universal symmetry or shape parameter ζ=0.0,0.6,0.7,0.8,0.9,1.0. The curves for ζ=0.0 and ζ=1.0 are labelled explicitly, the curves for other values of ζ interpolate between them.

[73.1.2.1] Consider now an ordinary critical point with a global symmetry such as in the Ising models. [73.1.2.2] Let X=Ψ be the order parameter which is assumed to be normalized such that D=1. [73.1.2.3] Then ϖX becomes ϖΨ=1+1/δ where δ is the equation of state exponent. [73.1.2.4] Abbreviating ζΨ as ζ the scaling function in equation (6.6) becomes

p~Ψx;δ,ζ,s=shx;1+1/δ,ζ,0,1+1-shx;1+1/δ,-ζ,0,1.(6.7)

[73.1.2.5] For the symmetric case s=1/2 the function p~Ψx;δ,ζ,s is displayed in Figures 2, 3 and 4 for δ=3,5,15 and several choices of ζ. [73.1.2.6] The symmetrization s=1/2 in (6.7) corresponds to an “equal weight rule” which is known to apply for first order transitions [42]. [73.1.2.7] Figure 2 shows the case δ=3 which is the value for the universality class of mean field models. [73.1.2.8] The six values for ζ in Figure 2 through 4 are ζ=0.0,0.6,0.7,0.8,0.9,1.0. [73.1.2.9] The case ζ=1.0 corresponds to the double peak structure with the widest peak separation while the value ζ=0.0 corresponds to the singly peaked function whose maximum has the smallest height. [73.1.2.10] Figure 3 shows the case δ=5 which is close to the value of δ4.8 [16] for the threedimensional Ising model. [73.1.2.11] The value δ=15 in Figure 4 is the value for the two dimensional Ising universality class.

Figure 3: Same as Figure 2 with δ=5 close to the d=3 Ising (δ4.8) universality class.

[73.1.2.12] The scaling functions displayed in Figures 2 through 4 are consistent with published data on critical scaling functions [7, 43, 44]. [73.1.2.13] Moreover it is seen that the universal shape parameter ζ is related to the type of boundary conditions. [73.1.2.14] Free boundary conditions apparently correspond to smaller values of the universal shape parameter ζ than periodic boundary conditions. [73.1.2.15] This correspondence between the value of ζ and the applied boundary conditions is not expected to be one to one. [73.1.2.16] The value of ζ may be influenced by other universal factors such as the type or symmetry of the pure phases. [page 74, §0]    [74.1.0.1] On the other hand the boundary conditions may also influence other parameters such as the value of the symmetrization s. [74.1.0.2] This is expected for boundary conditions which do not preserve the symmetry.

Figure 4: Same as Figure 2 with δ=15 corresponding to the d=2 Ising universality class.

[74.1.1.1] Figure 5 shows that the scaling functions are not merely consistent but also in good quantitative agreement with Monte-Carlo simulations of the twodimensional Ising model [43, 44, 45] where the exact value of δ and the location of the critical point for the infinite system are known. [74.1.1.2] The open circles in Figure 5 represent the smooth interpolation through the data published in [43, 44, 45]. [74.1.1.3] The solid line is the analytical prediction shown in Figure 4 for ζ=1. [74.1.1.4] For the comparison the nonuniversal scaling factors which were chosen to yield unit norm and variance in [43, 44, 45] were matched to those of the theoretical curve. [74.1.1.5] The excellent agreement between theory and simulation suggests to identify the value ζ=1 with periodic boundary conditions. [74.1.1.6] It is however not clear whether this identification will hold more generally.

Figure 5: Comparison between the scaling function p~Ψx;15,1,1/2 (solid line) for the order parameter density of the two dimensional Ising universality class (δ=15) with a smoothed interpolation through the simulation results of Refs.[43, 44, 45], (open circles) under the assumption that ζ=1 corresponds to periodic boundary conditions.