DFHelper

class psi4.core.DFHelper

Bases: pybind11_object

docstring

Methods Summary

add_space(self, arg0, arg1)
add_transformation(self, name, key1, key2[, ...])
clear_all(self)
clear_spaces(self)
get_AO_core(self)
get_AO_size(self)
get_MO_core(self)
get_memory(self)
get_method(self)
get_schwarz_cutoff(self)
get_space_size(self, arg0)
get_tensor(*args, **kwargs)	Overloaded function.
get_tensor_shape(self, arg0)
get_tensor_size(self, arg0)
hold_met(self, arg0)
initialize(self)
print_header(self)
set_AO_core(self, arg0)
set_MO_core(self, arg0)
set_memory(self, arg0)
set_method(self, arg0)
set_nthreads(self, arg0)
set_schwarz_cutoff(self, arg0)
set_subalgo(self, arg0)
transform(self)
transpose(self, arg0, arg1)

Methods Documentation

add_space(self: psi4.core.DFHelper, arg0: str, arg1: psi4.core.Matrix) → None

add_transformation(self: psi4.core.DFHelper, name: str, key1: str, key2: str, order: str = 'Qpq') → None

clear_all(self: psi4.core.DFHelper) → None

clear_spaces(self: psi4.core.DFHelper) → None

get_AO_core(self: psi4.core.DFHelper) → bool

get_AO_size(self: psi4.core.DFHelper) → int

get_MO_core(self: psi4.core.DFHelper) → bool

get_memory(self: psi4.core.DFHelper) → int

get_method(self: psi4.core.DFHelper) → str

get_schwarz_cutoff(self: psi4.core.DFHelper) → float

get_space_size(self: psi4.core.DFHelper, arg0: str) → int

get_tensor(*args, **kwargs)

Overloaded function.

1. get_tensor(self: psi4.core.DFHelper, arg0: str) -> psi4.core.Matrix

2. get_tensor(self: psi4.core.DFHelper, arg0: str, arg1: list[int], arg2: list[int], arg3: list[int]) -> psi4.core.Matrix

get_tensor_shape(self: psi4.core.DFHelper, arg0: str) → tuple[int, int, int]

get_tensor_size(self: psi4.core.DFHelper, arg0: str) → int

hold_met(self: psi4.core.DFHelper, arg0: bool) → None

initialize(self: psi4.core.DFHelper) → None

print_header(self: psi4.core.DFHelper) → None

set_AO_core(self: psi4.core.DFHelper, arg0: bool) → None

set_MO_core(self: psi4.core.DFHelper, arg0: bool) → None

set_memory(self: psi4.core.DFHelper, arg0: int) → None

set_method(self: psi4.core.DFHelper, arg0: str) → None

set_nthreads(self: psi4.core.DFHelper, arg0: int) → None

set_schwarz_cutoff(self: psi4.core.DFHelper, arg0: float) → None

set_subalgo(self: psi4.core.DFHelper, arg0: str) → None

transform(self: psi4.core.DFHelper) → None

transpose(self: psi4.core.DFHelper, arg0: str, arg1: tuple[int, int, int]) → None