psi4.core.Dispersion¶

class psi4.core.Dispersion¶

Bases: object

docstring

Methods Summary

`a1`((self: psi4.core.Dispersion) -> float)	docstring
`a2`((self: psi4.core.Dispersion) -> float)	docstring
`bibtex`((self: psi4.core.Dispersion) -> str)	Get the BibTeX key for the literature reference.
`build`((type: str, s6: float=0.0, ...)	docstring
`citation`((self: psi4.core.Dispersion) -> str)	docstring
`compute_energy`((self: psi4.core.Dispersion, ...)	docstring
`compute_gradient`(...)	docstring
`compute_hessian`((self: psi4.core.Dispersion, ...)	docstring
`d`((self: psi4.core.Dispersion) -> float)	docstring
`description`((self: psi4.core.Dispersion) -> str)	docstring
`name`((self: psi4.core.Dispersion) -> str)	docstring
`print_energy`((self: psi4.core.Dispersion, ...)	docstring
`print_gradient`((self: psi4.core.Dispersion, ...)	docstring
`print_hessian`((self: psi4.core.Dispersion, ...)	docstring
`print_out`((self: psi4.core.Dispersion) -> None)	docstring
`s6`((self: psi4.core.Dispersion) -> float)	docstring
`s8`((self: psi4.core.Dispersion) -> float)	docstring
`set_bibtex`((self: psi4.core.Dispersion, ...)	Set the BibTeX key for the literature reference.
`set_citation`((self: psi4.core.Dispersion, ...)	docstring
`set_description`((self: psi4.core.Dispersion, ...)	docstring
`set_name`((self: psi4.core.Dispersion, ...)	docstring
`sr6`((self: psi4.core.Dispersion) -> float)	docstring

Methods Documentation

a1(self: psi4.core.Dispersion) → float¶: docstring

a2(self: psi4.core.Dispersion) → float¶: docstring

bibtex(self: psi4.core.Dispersion) → str¶: Get the BibTeX key for the literature reference.

build(type: str, s6: float=0.0, p1: float=0.0, p2: float=0.0, p3: float=0.0) → psi4.core.Dispersion¶: docstring

citation(self: psi4.core.Dispersion) → str¶: docstring

compute_energy(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → float¶: docstring

compute_gradient(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → psi4.core.Matrix¶: docstring

compute_hessian(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → psi4.core.Matrix¶: docstring

d(self: psi4.core.Dispersion) → float¶: docstring

description(self: psi4.core.Dispersion) → str¶: docstring

name(self: psi4.core.Dispersion) → str¶: docstring

print_energy(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str¶: docstring

print_gradient(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str¶: docstring

print_hessian(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str¶: docstring

print_out(self: psi4.core.Dispersion) → None¶: docstring

s6(self: psi4.core.Dispersion) → float¶: docstring

s8(self: psi4.core.Dispersion) → float¶: docstring

set_bibtex(self: psi4.core.Dispersion, arg0: str) → None¶: Set the BibTeX key for the literature reference.

set_citation(self: psi4.core.Dispersion, arg0: str) → None¶: docstring

set_description(self: psi4.core.Dispersion, arg0: str) → None¶: docstring

set_name(self: psi4.core.Dispersion, arg0: str) → None¶: docstring

sr6(self: psi4.core.Dispersion) → float¶: docstring

a1(self: psi4.core.Dispersion) → float: docstring

a2(self: psi4.core.Dispersion) → float: docstring

bibtex(self: psi4.core.Dispersion) → str: Get the BibTeX key for the literature reference.

build(type: str, s6: float=0.0, p1: float=0.0, p2: float=0.0, p3: float=0.0) → psi4.core.Dispersion: docstring

citation(self: psi4.core.Dispersion) → str: docstring

compute_energy(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → float: docstring

compute_gradient(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → psi4.core.Matrix: docstring

compute_hessian(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → psi4.core.Matrix: docstring

d(self: psi4.core.Dispersion) → float: docstring

description(self: psi4.core.Dispersion) → str: docstring

name(self: psi4.core.Dispersion) → str: docstring

print_energy(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str: docstring

print_gradient(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str: docstring

print_hessian(self: psi4.core.Dispersion, arg0: psi4.core.Molecule) → str: docstring

print_out(self: psi4.core.Dispersion) → None: docstring

s6(self: psi4.core.Dispersion) → float: docstring

s8(self: psi4.core.Dispersion) → float: docstring

set_bibtex(self: psi4.core.Dispersion, arg0: str) → None: Set the BibTeX key for the literature reference.

set_citation(self: psi4.core.Dispersion, arg0: str) → None: docstring

set_description(self: psi4.core.Dispersion, arg0: str) → None: docstring

set_name(self: psi4.core.Dispersion, arg0: str) → None: docstring

sr6(self: psi4.core.Dispersion) → float: docstring