| /dports/science/nwchem-data/nwchem-7.0.2-release/src/driver/ |
| H A D | lbfgs_driver.F | 8 integer irtdb local
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| H A D | lbfgs-b_driver.F | 49 integer irtdb local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/qmmm/ |
| H A D | qmmm_link.F | 4 subroutine qmmm_links_init(irtdb) argument
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| H A D | qmmm_bq_data.F | 1 subroutine qmmm_bq_data_init(irtdb) argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/qmmm/ |
| H A D | task_qmmm_dynamics.F | 148 integer irtdb local
|
| H A D | qmmm_pes.F | 19 integer irtdb local
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| H A D | qmmm_bq_data.F | 1 subroutine qmmm_bq_data_init(irtdb) argument
9 integer irtdb local
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| H A D | task_qmmm_energy.F | 1287 integer irtdb local
1537 integer irtdb local
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| H A D | task_qmmm_gradient.F | 257 integer irtdb local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/argos/ |
| H A D | argos_input.F | 1 subroutine argos_input(irtdb) argument
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| H A D | argos_diana_input.F | 1 subroutine argos_diana_input(irtdb) argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/nwmd/ |
| H A D | md_input.F | 1 subroutine md_input(irtdb) argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/nwmd/ |
| H A D | md_input.F | 1 subroutine md_input(irtdb) argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/argos/ |
| H A D | argos_input.F | 1 subroutine argos_input(irtdb) argument
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| H A D | argos_diana_input.F | 1 subroutine argos_diana_input(irtdb) argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/optim/neb/ |
| H A D | neb_input.F | 384 integer irtdb local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/geom/ |
| H A D | geom.F | 8057 integer irtdb local
8237 integer irtdb local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/geom/ |
| H A D | geom.F | 8063 integer irtdb local
8243 integer irtdb local
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/analyz/ |
| H A D | ana_input.F | 1 subroutine ana_input(irtdb) argument
12 integer irtdb local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/analyz/ |
| H A D | ana_input.F | 1 subroutine ana_input(irtdb) argument
12 integer irtdb local
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/diana/ |
| H A D | dia_input.F | 1 subroutine dia_input(irtdb) argument
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| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/diana/ |
| H A D | dia_input.F | 1 subroutine dia_input(irtdb) argument
|
| /dports/science/nwchem/nwchem-7b21660b82ebd85ef659f6fba7e1e73433b0bd0a/src/prepar/ |
| H A D | pre_charge.F | 35 integer irtdb,lfnout,lfnpar,jlo,ilo,ihi,jhi local
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| H A D | pre_input.F | 1 subroutine pre_input(irtdb) argument
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| /dports/science/nwchem-data/nwchem-7.0.2-release/src/prepar/ |
| H A D | pre_input.F | 1 subroutine pre_input(irtdb) argument
|