Searched refs:xas_write_restart (Results 1 – 4 of 4) sorted by relevance
| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | xas_restart.F | 77 PUBLIC :: xas_read_restart, xas_write_restart, xas_initialize_rho, find_excited_core_orbital
276 SUBROUTINE xas_write_restart(xas_env, xas_section, qs_env, xas_method, iatom, istate) subroutine
355 END SUBROUTINE xas_write_restart
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| H A D | xas_tp_scf.F | 101 xas_write_restart
329 CALL xas_write_restart(xas_env, xas_section, qs_env, xas_control%xas_method, &
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | xas_restart.F | 77 PUBLIC :: xas_read_restart, xas_write_restart, xas_initialize_rho, find_excited_core_orbital
276 SUBROUTINE xas_write_restart(xas_env, xas_section, qs_env, xas_method, iatom, istate) subroutine
355 END SUBROUTINE xas_write_restart
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| H A D | xas_tp_scf.F | 101 xas_write_restart
329 CALL xas_write_restart(xas_env, xas_section, qs_env, xas_control%xas_method, &
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