| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/smd/graveyard/smd-9-10-08/ |
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/smd/graveyard/smd-original/ |
| H A D | ewald_excl.f | 15 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_real.f | 15 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 17 real*8 evdw,rij,drij,rijsq,force,etmp local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/smd/graveyard/smd-serial/ |
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/smd/graveyard/smd-subgroups/ |
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/smd/graveyard/smd-subgroups/ |
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/smd/graveyard/smd-original/ |
| H A D | ewald_excl.f | 15 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_real.f | 15 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 17 real*8 evdw,rij,drij,rijsq,force,etmp local
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/smd/graveyard/smd-serial/ |
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/nwchem-data/nwchem-7.0.2-release/src/smd/graveyard/smd-9-10-08/ |
| H A D | ewald_real.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | ewald_excl.f | 19 real*8 rij,drij,arij,rijsq local
|
| H A D | frce_shrt.f | 21 real*8 evdw,rij,drij,rijsq,force local
|
| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | manybody_tersoff.F | 51 full_loc_list, loc_cell_v, cell_v, drij) argument
60 REAL(KIND=dp) :: drij local
361 REAL(KIND=dp) :: cell_v_2(3), costheta, drij, drik, & local
427 REAL(KIND=dp) :: costheta, drij, drik, expterm, & local
599 REAL(KIND=dp) :: b_ij, b_ij_d, drij, f_A, f_A1, f_A2, & local
|