参数设置问题

[zc994646659]

This is mcsolver's save file, version: 2.3
Lattice:
1.000000000 0.000000000 0.000000000
0.000000000 1.000000000 0.000000000
0.000000000 0.000000000 0.988000000
Supercell used in MC simulations:
8 8 8
Orbitals in cell:
4
Postions, initial spin states and onsite-anisotropy of every orbitals:
orb 0: type 0 spin 1.500000000 pos [0.0000000014324610 0.9999999995976279 0.9999999955755224] Dx 0.000000000 Dy 0.000000000 Dz 0.000000000 h 0.000000000
orb 1: type 0 spin -1.500000000 pos [0.9999999980583267 0.5000000005806763 0.5000000006137180] Dx 0.000000000 Dy 0.000000000 Dz 0.000000000 h 0.000000000
orb 2: type 0 spin 1.500000000 pos [ 0.4999999978528786 0.0000000008749412 0.5000000004321106] Dx 0.000000000 Dy 0.000000000 Dz 0.000000000 h 0.000000000
orb 3: type 0 spin -1.500000000 pos [0.5000000024815558 0.4999999993270164 0.0000000036736649] Dx 0.000000000 Dy 0.000000000 Dz 0.000000000 h 0.000000000
Bonds:
48
id, source, target, overLat, exchange matrix elements of each bond:
bond 0: Jx -105.923 Jy -105.923 Jz -105.923 orb 0 to orb 2 over [0 1 0]
bond 1: Jx -105.904 Jy -105.904 Jz -105.904 orb 1 to orb 3 over [0 0 0]
bond 2: Jx -105.904 Jy -105.904 Jz -105.904 orb 1 to orb 3 over [0 0 1]
bond 3: Jx -105.923 Jy -105.923 Jz -105.923 orb 0 to orb 2 over [-1 1 0]
bond 4: Jx -105.923 Jy -105.923 Jz -105.923 orb 0 to orb 2 over [0 1 1]
bond 5: Jx -105.906 Jy -105.906 Jz -105.906 orb 1 to orb 3 over [1 0 0]
bond 6: Jx -105.909 Jy -105.909 Jz -105.909 orb 1 to orb 3 over [1 0 1]
bond 7: Jx -105.929 Jy -105.929 Jz -105.929 orb 0 to orb 2 over [-1 1 1]
bond 8: Jx -477.895 Jy -477.895 Jz -477.895 orb 0 to orb 1 over [-1 0 0]
bond 9: Jx -477.895 Jy -477.895 Jz -477.895 orb 2 to orb 3 over [0 0 0]
bond 10: Jx -477.895 Jy -477.895 Jz -477.895 orb 0 to orb 1 over [-1 1 0]
bond 11: Jx -477.895 Jy -477.895 Jz -477.895 orb 2 to orb 3 over [0 -1 0]
bond 12: Jx -477.887 Jy -477.887 Jz -477.887 orb 2 to orb 3 over [0 0 1]
bond 13: Jx -477.887 Jy -477.887 Jz -477.887 orb 0 to orb 1 over [-1 0 1]
bond 14: Jx -477.887 Jy -477.887 Jz -477.887 orb 2 to orb 3 over [0 -1 1]
bond 15: Jx -477.887 Jy -477.887 Jz -477.887 orb 0 to orb 1 over [-1 1 1]
bond 16: Jx -425.829 Jy -425.829 Jz -425.829 orb 0 to orb 3 over [-1 1 1]
bond 17: Jx -425.822 Jy -425.822 Jz -425.822 orb 0 to orb 3 over [-1 0 1]
bond 18: Jx -425.825 Jy -425.825 Jz -425.825 orb 1 to orb 2 over [0 0 0]
bond 19: Jx -425.822 Jy -425.822 Jz -425.822 orb 1 to orb 2 over [1 0 0]
bond 20: Jx -425.829 Jy -425.829 Jz -425.829 orb 1 to orb 2 over [1 1 0]
bond 21: Jx -425.831 Jy -425.831 Jz -425.831 orb 0 to orb 3 over [0 1 1]
bond 22: Jx -425.831 Jy -425.831 Jz -425.831 orb 1 to orb 2 over [0 1 0]
bond 23: Jx -425.825 Jy -425.825 Jz -425.825 orb 0 to orb 3 over [0 0 1]
bond 24: Jx 47.52819 Jy 47.52819 Jz 47.52819 orb 2 to orb 2 over [0 0 1]
bond 25: Jx 47.53473 Jy 47.53473 Jz 47.53473 orb 0 to orb 0 over [0 0 -1]
bond 26: Jx 47.5510 Jy 47.5510 Jz 47.5510 orb 1 to orb 1 over [0 0 -1]
bond 27: Jx 47.52819 Jy 47.52819 Jz 47.52819 orb 2 to orb 2 over [0 0 -1]
bond 28: Jx 47.5510 Jy 47.5510 Jz 47.5510 orb 3 to orb 3 over [0 0 -1]
bond 29: Jx 47.53473 Jy 47.53473 Jz 47.53473 orb 0 to orb 0 over [0 0 1]
bond 30: Jx 47.5510 Jy 47.5510 Jz 47.5510 orb 1 to orb 1 over [0 0 1]
bond 31: Jx 47.5510 Jy 47.5510 Jz 47.5510 orb 3 to orb 3 over [0 0 1]
bond 32: Jx 43.12406 Jy 43.12406 Jz 43.12406 orb 0 to orb 0 over [-1 0 0]
bond 33: Jx 43.12174 Jy 43.12174 Jz 43.12174 orb 1 to orb 1 over [-1 0 0]
bond 34: Jx 43.11942 Jy 43.11942 Jz 43.11942 orb 2 to orb 2 over [-1 0 0]
bond 35: Jx 43.12406 Jy 43.12406 Jz 43.12406 orb 3 to orb 3 over [-1 0 0]
bond 36: Jx 43.12406 Jy 43.12406 Jz 43.12406 orb 0 to orb 0 over [1 0 0]
bond 37: Jx 43.12174 Jy 43.12174 Jz 43.12174 orb 1 to orb 1 over [1 0 0]
bond 38: Jx 43.11942 Jy 43.11942 Jz 43.11942 orb 2 to orb 2 over [1 0 0]
bond 39: Jx 43.12406 Jy 43.12406 Jz 43.12406 orb 3 to orb 3 over [1 0 0]
bond 40: Jx 583.685 Jy 583.685 Jz 583.685 orb 1 to orb 1 over [0 1 0]
bond 41: Jx 583.686 Jy 583.686 Jz 583.686 orb 0 to orb 0 over [0 -1 0]
bond 42: Jx 583.685 Jy 583.685 Jz 583.685 orb 1 to orb 1 over [0 -1 0]
bond 43: Jx 583.680 Jy 583.680 Jz 583.680 orb 2 to orb 2 over [0 -1 0]
bond 44: Jx 583.685 Jy 583.685 Jz 583.685 orb 3 to orb 3 over [0 -1 0]
bond 45: Jx 583.686 Jy 583.686 Jz 583.686 orb 0 to orb 0 over [0 1 0]
bond 46: Jx 583.680 Jy 583.680 Jz 583.680 orb 2 to orb 2 over [0 1 0]
bond 47: Jx 583.685 Jy 583.685 Jz 583.685 orb 3 to orb 3 over [0 1 0]

Temperature scanning region:
Tmin 200 Tmax 1000 nT 100
Mesurement:
mesure the correlation function between orb0 and orb0 over [0 0 0]
Sweeps for thermalization and statistics, and relaxiation step for each sweep:
80000 640000 0
Dipole long range correction:
alpha 0.0
Field scanning region:
Hmin 0 Hmax 0.1 nH 1
Distribution output frame: 0
OrbGroup: 1
XAxis type:
T
Model type:
Heisenberg
Algorithm:
Wolff
Ncores:
4
设置了这样的反铁磁参数，最后运行报错，IndexError: list index out of range 哪个超出了范围。。

[HiHfJj]

可能是因为你使用的是Heisenberg模型，但是你缺少各向异性的信息，你这里试试换成Ising模型看看行不行呢？

[e-xx666]

能否请教各位老师一个问题，海森堡模型能不能设置设置磁各向异性为0（因为我没有加SOC），我就求了一个J。我的Jx、Jy、Jz可不可以设置成一样？