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Name Date Size #Lines LOC

..09-Apr-2021-

basisset.pyH A D09-Apr-202131.1 KiB996652

bundle.pyH A D09-Apr-202112.4 KiB350204

debug.pyH A D09-Apr-20211.7 KiB4412

developer.pyH A D09-Apr-202112.2 KiB347264

execute.pyH A D09-Apr-20211.5 KiB3915

fileio.pyH A D09-Apr-202153.7 KiB1,5911,095

gamess.pyH A D09-Apr-202111.6 KiB291164

gamess_analyzer.pyH A D09-Apr-202117.5 KiB492341

gamess_input.pyH A D09-Apr-202145.5 KiB1,307870

gaussian_process.pyH A D09-Apr-202170.9 KiB2,2631,562

generic.pyH A D09-Apr-202136.5 KiB1,352865

grid_functions.pyH A D09-Apr-2021168.2 KiB4,8023,601

hdfreader.pyH A D09-Apr-202111.4 KiB395222

machines.pyH A D09-Apr-2021108.9 KiB3,3092,277

memory.pyH A D09-Apr-20213.5 KiB11870

nexus.pyH A D09-Apr-202125.1 KiB597385

nexus_base.pyH A D09-Apr-20218.3 KiB232147

numerics.pyH A D09-Apr-202146.7 KiB1,474952

observables.pyH A D09-Apr-202147.7 KiB1,5551,094

periodic_table.pyH A D09-Apr-202167.6 KiB1,9061,758

physical_system.pyH A D09-Apr-202124.3 KiB789496

plotting.pyH A D09-Apr-20211.9 KiB4523

project_manager.pyH A D09-Apr-202113 KiB386244

pseudopotential.pyH A D09-Apr-202170.6 KiB2,1491,419

pwscf.pyH A D09-Apr-202112.8 KiB351247

pwscf_analyzer.pyH A D09-Apr-202133.2 KiB938674

pwscf_data_reader.pyH A D09-Apr-20216.5 KiB218142

pwscf_input.pyH A D09-Apr-202193.8 KiB2,7631,771

pwscf_postprocessors.pyH A D09-Apr-202128.8 KiB907514

pyscf_analyzer.pyH A D09-Apr-20211 KiB253

pyscf_input.pyH A D09-Apr-202112.1 KiB340246

pyscf_sim.pyH A D09-Apr-20213.7 KiB11558

qmcpack.pyH A D09-Apr-202123.7 KiB569385

qmcpack_analyzer.pyH A D09-Apr-202125.9 KiB779522

qmcpack_analyzer_base.pyH A D09-Apr-202120.8 KiB651352

qmcpack_converters.pyH A D09-Apr-202134.7 KiB1,136719

qmcpack_input.pyH A D09-Apr-2021264 KiB7,6645,552

qmcpack_method_analyzers.pyH A D09-Apr-202111.6 KiB319212

qmcpack_property_analyzers.pyH A D09-Apr-202111.4 KiB352220

qmcpack_quantity_analyzers.pyH A D09-Apr-2021116.6 KiB3,4442,279

qmcpack_result_analyzers.pyH A D09-Apr-202115.2 KiB460313

quantum_package.pyH A D09-Apr-202115.5 KiB416271

quantum_package_analyzer.pyH A D09-Apr-20211 KiB253

quantum_package_input.pyH A D09-Apr-202126.9 KiB764529

rmg.pyH A D09-Apr-20211.8 KiB7033

rmg_analyzer.pyH A D09-Apr-202115.9 KiB431324

rmg_input.pyH A D09-Apr-2021106.1 KiB3,5562,897

simulation.pyH A D09-Apr-202159.5 KiB1,8001,099

structure.pyH A D09-Apr-2021237.6 KiB7,3325,145

superstring.pyH A D09-Apr-202112 KiB532340

template_simulation.pyH A D09-Apr-202113.1 KiB35566

testing.pyH A D09-Apr-202119.7 KiB728483

unit_converter.pyH A D09-Apr-20217.6 KiB208122

utilities.pyH A D09-Apr-20213.5 KiB11859

vasp.pyH A D09-Apr-20216.6 KiB183103

vasp_analyzer.pyH A D09-Apr-202127.6 KiB903598

vasp_input.pyH A D09-Apr-202152.1 KiB1,7271,126

versions.pyH A D09-Apr-202130.2 KiB920702

xmlreader.pyH A D09-Apr-202114.7 KiB459277