SimuBox.schema.enums.SCFTEnums module¶

class SimuBox.schema.enums.SCFTEnums.Cells(value, names=None, *, module=None, qualname=None, type=None, start=1, boundary=None)¶

基类：IntEnum

枚举元胞参数。

lx = 0¶

ly = 1¶

lyx = 3¶

lz = 2¶

lzx = 4¶

lzy = 5¶

class SimuBox.schema.enums.SCFTEnums.Ensemble(value, names=None, *, module=None, qualname=None, type=None, start=1, boundary=None)¶

基类：StrEnum

正则/巨正则系综

CANONICAL = 'CANONICAL'¶

GRANDCANONICAL = 'GRANDCANONICAL'¶

class SimuBox.schema.enums.SCFTEnums.Servers(value, names=None, *, module=None, qualname=None, type=None, start=1, boundary=None)¶

基类：StrEnum

选择运算服务器。

cpuTOPS = 'cpuTOPS'¶

gpuSCFT = 'gpuSCFT'¶

gpuTOPS = 'gpuTOPS'¶