DIISManager

class psi4.core.DIISManager

Bases: pybind11_builtins.pybind11_object

docstring

Methods Summary

add_entry(*args, **kwargs)	Overloaded function.
delete_diis_file(self)	docstring
reset_subspace(self)	docstring
set_error_vector_size(*args, **kwargs)	Overloaded function.
set_vector_size(*args, **kwargs)	Overloaded function.

Methods Documentation

add_entry(*args, **kwargs)

Overloaded function.

1. add_entry(self: psi4.core.DIISManager, arg0: psi::Matrix, arg1: psi::Matrix) -> None

2. add_entry(self: psi4.core.DIISManager, arg0: psi::Matrix, arg1: psi::Matrix, arg2: psi::Matrix, arg3: psi::Matrix) -> None

delete_diis_file(self: psi4.core.DIISManager) → None

docstring

reset_subspace(self: psi4.core.DIISManager) → None

docstring

set_error_vector_size(*args, **kwargs)

Overloaded function.

1. set_error_vector_size(self: psi4.core.DIISManager, arg0: psi::Matrix) -> None

2. set_error_vector_size(self: psi4.core.DIISManager, arg0: psi::Matrix, arg1: psi::Matrix) -> None

set_vector_size(*args, **kwargs)

Overloaded function.

1. set_vector_size(self: psi4.core.DIISManager, arg0: psi::Matrix) -> None

2. set_vector_size(self: psi4.core.DIISManager, arg0: psi::Matrix, arg1: psi::Matrix) -> None