v0.9.6

Bump version: 0.9.6-dev → 0.9.6

mofchecker v0.9.2

Bug Fixes

• pin pybind11 (d4213f0)
• pinning pybind does not help (7cd5c00)
• structure import (e64a793)

mofchecker v0.9.1

Bug Fixes

• functools.cached property needs to be backported for 3.7 (c4fb1b2)
• ru,c bond threshold (eaa9f58)

mofchecker v0.9.0

Features

• initial implementation of database lookup (#147) (2a57f1f)

mofchecker v0.8.2

Bug Fixes

• license classifier (39b0353)

mofchecker v0.8.1

Bug Fixes

• license classifier (ea6787b)

mofchecker v0.8.0

Features

• add B-C bond in cutoffs (1c433cf)
• add check for undercoordinated rare earth (#137) (cf7d838)
• addd checks property and names of checks (396a5ec)
• make pyeqeq optional (0f6bcc2)
• refactor, return indices, use less buggy EQEq implementation (#127) (bfe9d14), closes #112 #128
• symmetry hash (#141) (1ecdeb3)

Bug Fixes

• do not pin pymatgen (e2ff197)
• failing tests for descriptions (25ce4e7)
• include yml files in MANIFEST (a0cb305)
• loosen version limit om pymatgen (981f7df)
• oversensitive checks (#138) (499aa9f)
• oversensitive floating atom check (#140) (86d3f2d)
• remove unused cycle basis calculation (c3abcc2)
• remove unused cycle basis calculation (c22cb35)
• use set of wyckoff letters (fe6e6b9)

Documentation

• remove indent (cde3030)

mofchecker v0.7.1

Documentation

• update background on graph hashes (#117) (ec32b54)

mofchecker v0.7.0

Features

• improve hash (#108) (7765aeb)

Documentation

• fixing links (c43e919)

mofchecker v0.6.0

Features

• basic zeo++ check (#104) (9bd965a)

Bug Fixes

• including requirements.txt in MANIFEST.in (#109) (a960d56)

Documentation

• adding background to the docs (5af916b)