v0.84.6rc2

Full Changelog: v0.84.6rc1...v0.84.6rc2

v0.84.6rc1

What's Changed

• Automated dependency upgrades by @tschaume in #1161
• add batch_id_{eq_any,neq_any} filters

Full Changelog: v0.84.6rc0...v0.84.6rc1

v0.84.6rc0

What's Changed

• Automated dependency upgrades by @tschaume in #1160
• Configure query on request by @yang-ruoxi in #1073

Full Changelog: v0.84.5...v0.84.6rc0

v0.84.5

What's Changed

• Add BatchIdQuery

Full Changelog: v0.84.3...v0.84.5

v0.84.4

same as v0.84.3

v0.84.3

What's Changed

• Automated dependency upgrades by @tschaume in #1111
• Automated dependency upgrades by @tschaume in #1113
• update "R2SCAN" to "r2SCAN" to match enum convention by @tsmathis in #1112
• Automated dependency upgrades by @tschaume in #1114
• Automated dependency upgrades by @tschaume in #1115
• add completed_at field (+run_stats) to TaskDoc as root fields by @tsmathis in #1116
• update elasticity builder asserts by @tsmathis in #1117
• Remove deprecated Extra.allow from document models by @tsmathis in #1121
• Improve error handling in SymmetryData by @mkhorton in #1118
• Replace relocated GrainBoundary import by @DanielYang59 in #1122
• Automated dependency upgrades by @tschaume in #1120
• Bump codecov/codecov-action from 4.5.0 to 4.6.0 by @dependabot in #1125
• Fix TaskDoc.task_type by @esoteric-ephemera in #1128
• Fix for MaterialsBuilder when TaskDoc.tags is None by @mkhorton in #1124
• Run CI enum generation on forks outside MP by @esoteric-ephemera in #1129
• Feat: Add run types for GW calculations by @yanghan234 in #1105
• Automated dependency upgrades by @tschaume in #1130
• Automated dependency upgrades by @tschaume in #1132
• Automated dependency upgrades by @tschaume in #1134
• Automated dependency upgrades by @tschaume in #1136
• Automated dependency upgrades by @tschaume in #1138
• Automated dependency upgrades by @tschaume in #1139
• update pymatgen dependency by @yang-ruoxi in #1141
• Automated dependency upgrades by @tschaume in #1140
• Automated dependency upgrades by @tschaume in #1142
• expand run type check to include r2SCAN entries by @tsmathis in #1145
• Make species hash and coord hash optional in MoleculeMetadata by @Andrew-S-Rosen in #1151
• Bump codecov/codecov-action from 4.6.0 to 5.0.7 by @dependabot in #1147
• Fix serialization issue in XASDoc by @esoteric-ephemera in #1146
• Update release workflow to support PEP 625 for source distribution file names by @tsmathis in #1152
• Automated dependency upgrades by @tschaume in #1143
• Automated dependency upgrades by @tschaume in #1153
• Automated dependency upgrades by @tschaume in #1154
• Bump codecov/codecov-action from 5.0.7 to 5.1.1 by @dependabot in #1156
• Automated dependency upgrades by @tschaume in #1155

New Contributors

• @DanielYang59 made their first contribution in #1122
• @yanghan234 made their first contribution in #1105

Full Changelog: v0.84.2...v0.84.3

v0.84.3rc6

What's Changed

• Make species hash and coord hash optional in MoleculeMetadata by @Andrew-S-Rosen in #1151
• Bump codecov/codecov-action from 4.6.0 to 5.0.7 by @dependabot in #1147
• Fix serialization issue in XASDoc by @esoteric-ephemera in #1146
• Update release workflow to support PEP 625 for source distribution file names by @tsmathis in #1152
• Automated dependency upgrades by @tschaume in #1143

Full Changelog: 0.84.3rc4...v0.84.3rc6

v0.84.3rc5

What's Changed

• Make species hash and coord hash optional in MoleculeMetadata by @Andrew-S-Rosen in #1151
• Bump codecov/codecov-action from 4.6.0 to 5.0.7 by @dependabot in #1147
• Fix serialization issue in XASDoc by @esoteric-ephemera in #1146
• Update release workflow to support PEP 625 for source distribution file names by @tsmathis in #1152
• Automated dependency upgrades by @tschaume in #1143

Full Changelog: 0.84.3rc4...v0.84.3rc3

Full Changelog: v0.84.3rc3...v0.84.3rc5

0.84.3rc4

What's Changed

• Automated dependency upgrades by @tschaume in #1136
• Automated dependency upgrades by @tschaume in #1138
• Automated dependency upgrades by @tschaume in #1139
• update pymatgen dependency by @yang-ruoxi in #1141
• Automated dependency upgrades by @tschaume in #1140
• Automated dependency upgrades by @tschaume in #1142
• expand run type check to include r2SCAN entries by @tsmathis in #1145

Full Changelog: 0.84.3rc3...0.84.3rc4

0.84.3rc3

What's Changed

• Run CI enum generation on forks outside MP by @esoteric-ephemera in #1129
• Feat: Add run types for GW calculations by @yanghan234 in #1105
• Automated dependency upgrades by @tschaume in #1130
• Automated dependency upgrades by @tschaume in #1132
• Automated dependency upgrades by @tschaume in #1134

New Contributors

• @yanghan234 made their first contribution in #1105

Full Changelog: v0.84.3rc2...0.84.3rc3