Searched defs:energy_range (Results 1 – 7 of 7) sorted by relevance
| /dports/science/py-oddt/oddt-0.7/oddt/docking/ |
| H A D | AutodockVina.py | 27 energy_range=3, argument
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| /dports/science/py-gpaw/gpaw-21.6.0/gpaw/lrtddft/ |
| H A D | kssingle.py | 84 def emin_emax(energy_range): argument
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| H A D | excited_state.py | 395 def __init__(self, energy_range=None, direction=None): argument
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| /dports/science/py-pymatgen/pymatgen-2022.0.15/pymatgen/electronic_structure/ |
| H A D | boltztrap2.py | 430 energy_range=1.5, argument
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| H A D | cohp.py | 1308 def get_integrated_cohp_in_energy_range( argument
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| /dports/science/cp2k-data/cp2k-7.1.0/src/ |
| H A D | qs_energy_window.F | 96 REAL(KIND=dp) :: bin_width, density_ewindow_total, density_total, energy_range, fermi_level, & local
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| /dports/science/cp2k/cp2k-2e995eec7fd208c8a72d9544807bd8b8ba8cd1cc/src/ |
| H A D | qs_energy_window.F | 96 REAL(KIND=dp) :: bin_width, density_ewindow_total, density_total, energy_range, fermi_level, & local
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