occ
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#include <occ/qm/spinorbital.h>
Namespaces | |
namespace | occ |
namespace | occ::qm |
quantum mechanics/quantum chemistry functionality including Hartree-Fock and more | |
Functions | |
template<SpinorbitalKind kind, typename TA > | |
TA::Scalar | occ::qm::expectation (const TA &left, const TA &right) |
template<typename TA > | |
TA::Scalar | occ::qm::expectation (SpinorbitalKind sk, const TA &left, const TA &right) |