OneBodyAOInt¶

class
psi4.core.
OneBodyAOInt
¶ Bases:
pybind11_builtins.pybind11_object
Basis class for all oneelectron integrals
Attributes Summary
basis
The basis set on center one basis1
The basis set on center one basis2
The basis set on center two origin
The origin about which the one body ints are being computed. Methods Summary
compute_shell
(self, arg0, arg1)Compute integrals between basis functions in the given shell pair Attributes Documentation

basis
¶ The basis set on center one

basis1
¶ The basis set on center one

basis2
¶ The basis set on center two

origin
¶ The origin about which the one body ints are being computed.
Methods Documentation

compute_shell
(self: psi4.core.OneBodyAOInt, arg0: int, arg1: int) → None¶ Compute integrals between basis functions in the given shell pair

basis
The basis set on center one

basis1
The basis set on center one

basis2
The basis set on center two

compute_shell
(self: psi4.core.OneBodyAOInt, arg0: int, arg1: int) → None Compute integrals between basis functions in the given shell pair

origin
The origin about which the one body ints are being computed.
