Searched defs:qexsd_init_atomic_structure (Results 1 – 1 of 1) sorted by relevance
| /dports/science/quantum-espresso/q-e-qe-6.7.0/Modules/ |
| H A D | qexsd_init.f90 | 172 TYPE(atomic_structure_type) :: obj
173 INTEGER, INTENT(IN) :: nsp, nat
174 INTEGER, INTENT(in) :: ityp(:)
175 CHARACTER(LEN=*), INTENT(in) :: atm(:)
177 REAL(DP), INTENT(IN) :: alat
178 REAL(DP), INTENT(IN) :: a1(:), a2(:), a3(:)
179 INTEGER, INTENT(IN) :: ibrav
181 INTEGER :: ia
182 TYPE(atom_type), ALLOCATABLE :: atom(:)
183 TYPE(cell_type) :: cell
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