/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | topology_cp2k.F | 23 section_get_rval,& 113 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | qs_kpp1_env_methods.F | 35 section_get_rval,& 309 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 310 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 311 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | kg_correction.F | 24 section_get_rval,& 759 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 760 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 761 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | qs_tddfpt2_types.F | 43 section_get_rval,& 776 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 777 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 778 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | topology_xtl.F | 32 USE input_section_types, ONLY: section_get_rval,& 102 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | response_solver.F | 53 section_get_rval,& 562 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 563 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 564 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF")) 703 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 704 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 705 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | topology_cif.F | 36 USE input_section_types, ONLY: section_get_rval,& 114 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | topology_pdb.F | 65 USE input_section_types, ONLY: section_get_rval,& 124 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | qs_linres_methods.F | 66 section_get_rval,& 1031 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 1032 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 1033 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF")) 1783 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 1784 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 1785 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | energy_corrections.F | 80 section_get_rval,& 923 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 924 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 925 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | environment.F | 62 section_get_ival, section_get_keyword, section_get_lval, section_get_rval, & 1184 r_timings = section_get_rval(root_section, "GLOBAL%TIMINGS%THRESHOLD")
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H A D | topology_gromos.F | 21 USE input_section_types, ONLY: section_get_rval,& 654 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | optimize_embedding_potential.F | 50 section_get_rval,& 2996 rho_cutoff=section_get_rval(xc_section, "density_cutoff"), & 2997 drho_cutoff=section_get_rval(xc_section, "gradient_cutoff"), & 2998 tau_cutoff=section_get_rval(xc_section, "tau_cutoff"))
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | topology_cp2k.F | 23 section_get_rval,& 113 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | qs_kpp1_env_methods.F | 34 section_get_rval,& 308 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 309 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 310 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | topology_xtl.F | 32 USE input_section_types, ONLY: section_get_rval,& 102 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | topology_cif.F | 36 USE input_section_types, ONLY: section_get_rval,& 114 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | topology_pdb.F | 65 USE input_section_types, ONLY: section_get_rval,& 124 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | qs_linres_methods.F | 61 section_get_rval,& 1016 rho_cutoff=section_get_rval(xc_section, "DENSITY_CUTOFF"), & 1017 drho_cutoff=section_get_rval(xc_section, "GRADIENT_CUTOFF"), & 1018 tau_cutoff=section_get_rval(xc_section, "TAU_CUTOFF"))
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H A D | environment.F | 62 section_get_ival, section_get_keyword, section_get_lval, section_get_rval, & 1187 r_timings = section_get_rval(root_section, "GLOBAL%TIMINGS%THRESHOLD")
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H A D | topology_gromos.F | 21 USE input_section_types, ONLY: section_get_rval,& 654 pfactor = section_get_rval(subsys_section, "TOPOLOGY%MEMORY_PROGRESSION_FACTOR")
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H A D | optimize_embedding_potential.F | 50 section_get_rval,& 2996 rho_cutoff=section_get_rval(xc_section, "density_cutoff"), & 2997 drho_cutoff=section_get_rval(xc_section, "gradient_cutoff"), & 2998 tau_cutoff=section_get_rval(xc_section, "tau_cutoff"))
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/dports/science/cp2k-data/cp2k-7.1.0/src/input/ |
H A D | input_section_types.F | 69 section_get_rval, & 976 FUNCTION section_get_rval(section_vals, keyword_name) RESULT(res) function 984 END FUNCTION section_get_rval
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/input/ |
H A D | input_section_types.F | 69 section_get_rval, & 976 FUNCTION section_get_rval(section_vals, keyword_name) RESULT(res) function 984 END FUNCTION section_get_rval
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/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/xc/ |
H A D | xc.F | 24 section_get_rval,& 841 rho_cutoff=section_get_rval(xc_section, "density_cutoff"), & 842 drho_cutoff=section_get_rval(xc_section, "gradient_cutoff"), & 843 tau_cutoff=section_get_rval(xc_section, "tau_cutoff"))
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