pymatgen.analysis.chemenv.utils.chemenv_config module

class ChemEnvConfig(package_options=None)

Class used to store the configuration of the chemenv package :

• Materials project access
• ICSD database access
• Default options (strategies, …)

DEFAULT_PACKAGE_OPTIONS = {u'default_max_distance_factor': 1.5, u'default_strategy': {u'strategy': u'SimplestChemenvStrategy', u'strategy_options': {u'additional_condition': 1, u'angle_cutoff': 0.3, u'continuous_symmetry_measure_cutoff': 10.0, u'distance_cutoff': 1.4}}}

classmethod auto_load(root_dir=None)

has_materials_project_access

package_options_description()

save(root_dir=None)

setup()

setup_package_options()