AtomLike
|
alias of int | str | Atom |
AtomsLike
|
alias of int | str | Atom | Sequence [int | str | Atom ] | Atoms |
CellLike
|
alias of ndarray [tuple [int , ...], dtype [_ScalarType_co ]] | list | tuple |
Coord
|
All the operations on a read-only sequence. |
CoordOrScalar
|
alias of float | Sequence [float ] |
FuncType
|
alias of Callable [[...], Any ] |
GaugeType
|
alias of Literal ['lattice', 'atomic'] |
GeometryLike
|
alias of str | BaseSile | Path | Geometry |
GridLike
|
alias of str | BaseSile | Path | Grid |
KPoint
|
All the operations on a read-only sequence. |
LatticeLike
|
alias of str | BaseSile | Path | Lattice | LatticeChild | ndarray [tuple [int , ...], dtype [_ScalarType_co ]] | list | tuple |
LatticeOrGeometry
|
alias of Lattice | Geometry |
LatticeOrGeometryLike
|
alias of str | BaseSile | Path | Lattice | LatticeChild | ndarray [tuple [int , ...], dtype [_ScalarType_co ]] | list | tuple | Geometry |
ProjectionTypeMatrix
|
alias of Literal ['matrix', 'ij'] |
ProjectionTypeTrace
|
alias of Literal ['trace', 'sum'] |
ProjectionTypeDiag
|
alias of Literal ['diagonal', 'diag', 'ii'] |
ProjectionTypeHadamard
|
alias of Literal ['hadamard', 'basis'] |
ProjectionTypeHadamardAtoms
|
alias of Literal ['hadamard:atoms', 'atoms'] |
ProjectionType
|
alias of Literal ['matrix', 'ij'] | Literal ['diagonal', 'diag', 'ii'] | Literal ['trace', 'sum'] |
DistributionStr
|
alias of Literal ['gaussian', 'lorentzian', 'fermi', 'bose-einstein', 'cold', 'step-function', 'heaviside'] |
DistributionFunc
|
alias of Callable [[Buffer | _SupportsArray [dtype [Any ]] | _NestedSequence [_SupportsArray [dtype [Any ]]] | bool | int | float | complex | str | bytes | _NestedSequence [bool | int | float | complex | str | bytes ]], ndarray ] |
DistributionType
|
alias of Literal ['gaussian', 'lorentzian', 'fermi', 'bose-einstein', 'cold', 'step-function', 'heaviside'] | Callable [[Buffer | _SupportsArray [dtype [Any ]] | _NestedSequence [_SupportsArray [dtype [Any ]]] | bool | int | float | complex | str | bytes | _NestedSequence [bool | int | float | complex | str | bytes ]], ndarray ] |
SileLike
|
alias of str | BaseSile | Path |
SparseMatrix
|
alias of spmatrix | sparray | SparseCSR |
SparseMatrixExt
|
alias of spmatrix | sparray |
UnitsVar
|
alias of str | Mapping [str , str ] | Sequence [str ] |