@brief Copy density block from the triangular density matrix
@details This subroutine assumes shi%shid>=shj%shid
@param[in] shi first shell data
@param[in] shj second shell data
@param[in] dij density matrix in packed triangular form
@param[out] denab density matrix block for shells shi and shj
Note
Used in HELFEY-based subroutines @author Vladimir Mironov @date Sep, 2018 Initial release
Type | Intent | Optional | Attributes | Name | ||
---|---|---|---|---|---|---|
type(shell_t), | intent(in) | :: | shi | |||
type(shell_t), | intent(in) | :: | shj | |||
real(kind=REAL64), | intent(out), | CONTIGUOUS | :: | dij(:) | ||
real(kind=REAL64), | intent(in), | CONTIGUOUS | :: | denab(:) |