Searched refs:general_parameter (Results 1 – 10 of 10) sorted by relevance
/dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
H A D | hfx_admm_utils.F | 455 x_data(irep, 1)%general_parameter%fraction) 526 x_data(irep, 1)%general_parameter%fraction) 841 hfx_fraction = qs_env%x_data(1, 1)%general_parameter%fraction
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H A D | hfx_energy_potential.F | 225 TYPE(hfx_general_type) :: general_parameter local 432 general_parameter = actual_x_data%general_parameter 442 treat_lsd_in_core = general_parameter%treat_lsd_in_core 694 hf_fraction = general_parameter%fraction
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H A D | hfx_derivatives.F | 197 TYPE(hfx_general_type) :: general_parameter local 378 general_parameter = actual_x_data%general_parameter 410 hf_fraction = general_parameter%fraction
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H A D | mp2.F | 1442 hfx_fraction = qs_env%x_data(1, 1)%general_parameter%fraction 1443 qs_env%x_data(:, :)%general_parameter%fraction = 0.0_dp 1494 qs_env%x_data(:, :)%general_parameter%fraction = hfx_fraction
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H A D | hfx_types.F | 492 TYPE(hfx_general_type) :: general_parameter component 632 actual_x_data%general_parameter%fraction = real_val 638 actual_x_data%general_parameter%treat_lsd_in_core = logic_val 2689 "HFX_INFO| FRACTION: ", x_data%general_parameter%fraction
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/dports/science/cp2k-data/cp2k-7.1.0/src/ |
H A D | hfx_types.F | 374 TYPE(hfx_general_type) :: general_parameter component 501 actual_x_data%general_parameter%fraction = real_val 507 actual_x_data%general_parameter%treat_lsd_in_core = logic_val 1858 "HFX_INFO| FRACTION: ", x_data%general_parameter%fraction
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H A D | hfx_energy_potential.F | 225 TYPE(hfx_general_type) :: general_parameter local 432 general_parameter = actual_x_data%general_parameter 442 treat_lsd_in_core = general_parameter%treat_lsd_in_core 694 hf_fraction = general_parameter%fraction
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H A D | hfx_derivatives.F | 194 TYPE(hfx_general_type) :: general_parameter local 372 general_parameter = actual_x_data%general_parameter 404 hf_fraction = general_parameter%fraction
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H A D | mp2.F | 1441 hfx_fraction = qs_env%x_data(1, 1)%general_parameter%fraction 1442 qs_env%x_data(:, :)%general_parameter%fraction = 0.0_dp 1493 qs_env%x_data(:, :)%general_parameter%fraction = hfx_fraction
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H A D | hfx_admm_utils.F | 662 hfx_fraction = qs_env%x_data(1, 1)%general_parameter%fraction
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