emmet.builders.utils

Functions

chemsys_permutations

filter_map

Apply a function to each item in an iterable, yielding non-None results.

get_hop_cutoff

A function to get an appropriate hop distance cutoff for a given migration graph structure which can be used for MigrationGraph.with_distance()

get_potcar_stats

Get the POTCAR stats used in MP calculations to validate POTCARs.

maximal_spanning_non_intersecting_subsets

Finds the maximal spanning non intersecting subsets of a group of sets This is usefull for parsing out the sandboxes and figuring out how to group and calculate these for thermo documents

query_open_data

LEGACY FUNCTION - unmaintained

try_call

Attempt to call a function, returning a _default value if an exception is raised.

Classes

HiddenPrints

S

Type variable.

T

Type variable.

V

Type variable.