Kindfield
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This is the complete list of members for GaussianCore, including all inherited members.
atomType() const | GaussianCore | |
charge() const | GaussianCore | |
contractedOrbitals() const | GaussianCore | |
GaussianCore(Vector3 position=Vector3::createZeros(), string fileName="") | GaussianCore | |
GaussianCore(Vector3 position, int atomNumber, string basisName) | GaussianCore | |
GaussianCore(Vector3 position, string atomAbbreviation, string basisName) | GaussianCore | |
load(string fileName) | GaussianCore | |
nElectrons() const | GaussianCore | |
position() const | GaussianCore | |
setAtomType(const HF::AtomType &atomType) | GaussianCore | |
setCharge(int charge) | GaussianCore | |
setContractedOrbitals(const vector< GaussianContractedOrbital > &contractedOrbitals) | GaussianCore | |
setNElectrons(int nElectrons) | GaussianCore | |
setPosition(const Vector3 &position) | GaussianCore |