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Searched refs:basis_set_file_name (Results 1 – 6 of 6) sorted by relevance

/dports/science/cp2k-data/cp2k-7.1.0/src/aobasis/
H A Dbasis_set_types.F1271 basis_set_file_name = cbasis(ibasis)
1272 tmp = basis_set_file_name
1284 basis_set_file_name = cbasis(ibasis)
1533 basis_set_file_name = ""
1535 basis_set_file_name = TRIM(basis_set_file_name)//"<"//TRIM(cbasis(ibasis))//"> "
1541 TRIM(basis_set_file_name))
2281 basis_set_file_name = cbasis(ibasis)
2282 tmp = basis_set_file_name
2293 basis_set_file_name = cbasis(ibasis)
2385 basis_set_file_name = ""
[all …]
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/aobasis/
H A Dbasis_set_types.F1274 basis_set_file_name = cbasis(ibasis)
1275 tmp = basis_set_file_name
1287 basis_set_file_name = cbasis(ibasis)
1536 basis_set_file_name = ""
1538 basis_set_file_name = TRIM(basis_set_file_name)//"<"//TRIM(cbasis(ibasis))//"> "
1544 TRIM(basis_set_file_name))
2294 basis_set_file_name = cbasis(ibasis)
2295 tmp = basis_set_file_name
2306 basis_set_file_name = cbasis(ibasis)
2398 basis_set_file_name = ""
[all …]
/dports/science/cp2k-data/cp2k-7.1.0/src/
H A Denvironment.F495 CHARACTER(len=default_path_length) :: basis_set_file_name, coord_file_name, & local
707 c_val=basis_set_file_name)
732 ADJUSTR(basis_set_file_name(:40)), &
H A Dcp_control_utils.F93 CHARACTER(len=default_path_length) :: basis_set_file_name, potential_file_name local
328 c_val=basis_set_file_name)
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/
H A Denvironment.F492 CHARACTER(len=default_path_length) :: basis_set_file_name, coord_file_name, & local
704 c_val=basis_set_file_name)
729 ADJUSTR(basis_set_file_name(:40)), &
H A Dcp_control_utils.F93 CHARACTER(len=default_path_length) :: basis_set_file_name, potential_file_name local
347 c_val=basis_set_file_name)