public subroutine density_matrix_open(p, f, d)
open shell part of the density matrix
Arguments
| Type |
Intent | Optional | Attributes |
|
Name |
|
|
type(param),
|
intent(in) |
|
|
:: |
p |
|
|
type(wf_data),
|
intent(inout) |
|
|
:: |
f |
|
|
real(kind=long),
|
intent(inout), |
|
dimension(p%n_basis, p%n_basis)
|
:: |
d |
|