aiida-crystal17
v0.9.0b5
Getting Started
Basic Calculation Plugin
Main Calculation Plugin
Main Calculation Restart Workflow
Main Calculation Immigration
GULP Calculations
AiiDA CRYSTAL17 API
aiida_crystal17 package
Subpackages
aiida_crystal17.calcfunctions package
aiida_crystal17.calculations package
aiida_crystal17.cmndline package
aiida_crystal17.common package
aiida_crystal17.data package
aiida_crystal17.gulp package
aiida_crystal17.immigration package
aiida_crystal17.parsers package
aiida_crystal17.symmetry package
aiida_crystal17.tests package
aiida_crystal17.validation package
aiida_crystal17.workflows package
Module contents
aiida-crystal17
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AiiDA CRYSTAL17 API
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aiida_crystal17 package
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aiida_crystal17.workflows package
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aiida_crystal17.workflows package
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Subpackages
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aiida_crystal17.workflows.common package
Submodules
aiida_crystal17.workflows.common.restart module
Module contents
aiida_crystal17.workflows.crystal_main package
Submodules
aiida_crystal17.workflows.crystal_main.base module
Module contents
aiida_crystal17.workflows.crystal_props package
Submodules
aiida_crystal17.workflows.crystal_props.cry_doss module
Module contents
Submodules
¶
aiida_crystal17.workflows.symmetrise_3d_struct module
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Module contents
¶
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v: v0.9.0b5
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