Searched refs:geom_lattice_set (Results 1 – 12 of 12) sorted by relevance
/dports/science/nwchem-data/nwchem-7.0.2-release/src/geom/ |
H A D | geom.fh | 46 logical geom_lattice_set 155 external geom_lattice_set
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H A D | geom.F | 3087 logical geom_lattice_get,geom_lattice_set,geom_is_conventional 3088 external geom_lattice_get,geom_lattice_set,geom_is_conventional 3217 value = value.and.geom_lattice_set(geom,lat) 4327 logical function geom_lattice_set(geom,lattice) function 4348 geom_lattice_set = geom_check_handle(geom, 'geom_lattice_set') 4349 if (.not. geom_lattice_set) return
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/geom/ |
H A D | geom.fh | 46 logical geom_lattice_set 155 external geom_lattice_set
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H A D | geom.F | 3093 logical geom_lattice_get,geom_lattice_set,geom_is_conventional 3094 external geom_lattice_get,geom_lattice_set,geom_is_conventional 3223 value = value.and.geom_lattice_set(geom,lat) 4333 logical function geom_lattice_set(geom,lattice) function 4354 geom_lattice_set = geom_check_handle(geom, 'geom_lattice_set') 4355 if (.not. geom_lattice_set) return
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/driver/ |
H A D | lbfgs-b_driver.F | 379 if (.not. geom_lattice_set(igeom, dbl_mb(i_x+3*natom)))
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H A D | opt_drv.F | 3635 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/driver/ |
H A D | lbfgs-b_driver.F | 379 if (.not. geom_lattice_set(igeom, dbl_mb(i_x+3*natom)))
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H A D | opt_drv.F | 3674 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/optim/tropt/ |
H A D | tropt_drv.F | 2242 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/optim/tropt/ |
H A D | tropt_drv.F | 2237 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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/dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/optim/mepgs/ |
H A D | mepgs_drv.F | 2933 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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/dports/science/nwchem-data/nwchem-7.0.2-release/src/optim/mepgs/ |
H A D | mepgs_drv.F | 2921 if (.not. geom_lattice_set(geom, coords(3*nat_real+1)))
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