pypi emmet-core 0.60.2
v0.60.2
on Python PyPI

latest releases: 0.84.2rc10, 0.84.2rc9, 0.84.2rc8...
14 months ago

Version 0.60.2

Commits

  • [b228bc4] Don't calculate band properties if LORBIT < 11 (#783)
  • [900e3f2] upgrade dependencies for deployment
  • [5270367] upgrade dependencies for deployment
  • [c10464f] Automated dependency upgrades (#778)
  • [e5748a2] Updated CHANGELOG.md
  • [424deb5] Fix thermo material_id treatment in alloys (#780)
  • [bd93205] Electronic structure bug fixes (#779)
  • [d6b9d1e] upgrade dependencies for deployment
  • [341b033] upgrade dependencies for deployment
  • [316afa6] Automated dependency upgrades (#776)
  • [443160d] Updated CHANGELOG.md
  • [d1c0a90] Add sorting to messages api endpoint (#774)
  • [4ebb0d6] bump python image 3.1010.7
  • [7869b72] upgrade dependencies for deployment
  • [8b13c36] Automated dependency upgrades (#773)
  • [3d73236] Automated dependency upgrades (#771)
  • [4adc9c0] Updated CHANGELOG.md
  • [f5f855e] Pin pydantic (#770)
  • [b96e6a7] upgrade dependencies for deployment
  • [97119a6] upgrade dependencies for deployment
  • [7a971a4] Automated dependency upgrades (#766)
  • [a7bf5a1] Updated CHANGELOG.md
  • [c203d4b] Add AWS open data to ES builder (#756)
  • [b34aad0] Merge pull request #765 from materialsproject/cli_updates
  • [bdf1825] Fix for revision plus linting
  • [71cc657] Setting default task_id to anything less than 7 digits could result in task documents being overwritten in the test collection
  • [e982352] Setting next task_id to 1000001 not necessary
  • [fb47700] Add catch for parsing task documents into empty collections
  • [1cfc36b] Pymongo collection.ensure_index() deprecated in pymongo>=4.0, new function is collection.create_index()
  • [058aec5] cli: fix client var
  • [91ee6a4] cli: only check pattern if not reorg
  • [74e085c] cli: remove auto-yes
  • [063423f] Add patch resource (#761)
  • [07a915e] Automated dependency upgrades (#763)
  • [60e9697] upgrade dependencies for deployment
  • [c4580e2] upgrade dependencies for deployment
  • [cd8ab07] Automated dependency upgrades (#762)
  • [9b04651] Updated CHANGELOG.md
  • [edb9806] Ensure openbabel can stay an optional dep (#760)
  • [8de3751] upgrade dependencies for deployment
  • [257d702] disable MAX_REQUESTS/_JITTER
  • [7581a8d] Automated dependency upgrades (#759)
  • [3318bed] upgrade dependencies for deployment
  • [2d6d321] Updated CHANGELOG.md
  • [0083142] bump pymatgen to >=2023.5.8 (#758)
  • [88445cf] Updated CHANGELOG.md
  • [1774f3c] Metal binding data, trajectories, and the start of stereochemistry (#706)
  • [c7ae50e] upgrade dependencies for deployment
  • [7c9cffa] Automated dependency upgrades (#755)
  • [a74aa1d] Updated CHANGELOG.md
  • [8da9da4] Fix messages endpoint params (#754)
  • [68aba26] Updated CHANGELOG.md
  • [b253044] Add generic messages endpoint (#753)
  • [3aefb7a] upgrade dependencies for deployment
  • [06d1bb2] Automated dependency upgrades (#752)
  • [e6f907e] Automated dependency upgrades (#751)
  • [ebf884d] upgrade dependencies for deployment
  • [c1d2d3b] Updated CHANGELOG.md
  • [e4ec106] Fix task_id type in elasticity (#749)
  • [5a06cc2] Merge pull request #747 from blokhin/patch-1
  • [474e6fb] Add more info about the Optimade support
  • [659afe5] Ensure chemenv and absorption is incorporated into summary (#712)
  • [aa664e4] increase max requests/jitter
  • [de879bc] upgrade dependencies for deployment
  • [a0eb759] Automated dependency upgrades (#746)
  • [ea58b96] upgrade dependencies for deployment
  • [d0f1b52] bump python image 3.1010.4
  • [8a164f7] upgrade dependencies for deployment
  • [5e5c1f7] bump python image 3.1010.3
  • [a5133e3] Automated dependency upgrades (#744)
  • [e745ff0] Updated CHANGELOG.md
  • [1916a9c] fix formula_double_format() return type change str -> float (#745)
  • [24fcf8b] Automated dependency upgrades (#743)
  • [504838a] upgrade dependencies for deployment
  • [4c8bfcd] upgrade dependencies for deployment
  • [631ae6e] Automated dependency upgrades (#741)
  • [274d73a] upgrade dependencies for deployment
  • [e18587a] Automated dependency upgrades (#739)
  • [cdf51e2] Automated dependency upgrades (#736)
  • [6b2441e] upgrade dependencies for deployment
  • [47ae22c] upgrade dependencies for deployment
  • [7069f36] Automated dependency upgrades (#733)
  • [d7c5a90] upgrade dependencies for deployment
  • [c9bab69] Automated dependency upgrades (#732)
  • [620d99b] Updated CHANGELOG.md
  • [e5e44f6] Fix molecule collection names
  • [411b9c4] Updated CHANGELOG.md
  • [aaa34a4] Fix summary sub path (#726)
  • [cddd9b8] upgrade dependencies for deployment
  • [8d8377f] Automated dependency upgrades (#725)
  • [de2d700] upgrade dependencies for deployment
  • [f374858] Automated dependency upgrades (#724)
  • [abd2ffe] Updated CHANGELOG.md
  • [23dd61d] Elastic builder (#721)
  • [435a19a] More linting
  • [05b74e5] Fix wflow dep
  • [903f28f] Fix linting wflow
  • [dd20f1f] Automated dependency upgrades (#723)
  • [43e25b2] Pre-commit linting
  • [b71efd6] Remove codespell
  • [4a6047c] Updated CHANGELOG.md
  • [010d8c8] Optimade builder (#722)
  • [24009de] Automated dependency upgrades (#720)
  • [7f2ed51] correct import of EmmetSetting (#716)
  • [6824b6e] Updated CHANGELOG.md
  • [f6b5fee] Automated dependency upgrades (#718)
  • [42bee4d] Updated CHANGELOG.md
  • [8681520] Change type of epsilon_* (#719)
  • [bec46aa] upgrade dependencies for deployment
  • [f746114] upgrade dependencies for deployment
  • [6c539ce] Automated dependency upgrades (#715)
  • [32ce1f9] Updated CHANGELOG.md
  • [46c619c] Add second PBEsol enum variant (#714)
  • [2329480] api: print commands in start.sh
  • [2289aff] Automated dependency upgrades (#713)
  • [31ceb14] Updated CHANGELOG.md
  • [48d7de3] Fix obtaining origin data in summary builder (#711)
  • [935084a] bump python image 3.1010.2
  • [2aa16c0] upgrade dependencies for deployment
  • [401ad4f] Automated dependency upgrades (#710)
  • [c67090f] Updated CHANGELOG.md
  • [beb7524] Fix core nesting (#709)
  • [d80071e] upgrade dependencies for deployment
  • [184b9ea] Automated dependency upgrades (#699)
  • [9c0a9a0] Updated CHANGELOG.md
  • [1aa9a24] Fix molecules and materials route nesting (#707)
  • [1ecf290] Updated CHANGELOG.md
  • [19b153b] Task doc validation changes (#705)
  • [513ef4c] upgrade dependencies for deployment
  • [d921376] Updated CHANGELOG.md
  • [4f06660] Chemenv additions (#703)
  • [b58b745] upgrade dependencies for deployment
  • [705c319] Updated CHANGELOG.md
  • [8c60027] Restructure the Materials Project [WIP] (#698)
  • [7b246af] upgrade dependencies for deployment
  • [31696f4] upgrade dependencies for deployment
  • [209c26f] Automated dependency upgrades (#694)
  • [85f9db7] Updated CHANGELOG.md
  • [9778756] Default to calcs_reversed structure in valid (#697)
  • [0c6f45e] Updated CHANGELOG.md
  • [2682d3d] Origin data audit (#696)
  • [a452bb0] upgrade dependencies for deployment
  • [920edf8] Updated CHANGELOG.md
  • [7c3273d] Update MoleculeMetadata (#691)
  • [4dd237b] Updated CHANGELOG.md
  • [7894414] Add ddb source to sound velocity builder (#690)
  • [12634e9] Fix ddb data pulling (#689)
  • [f332e4d] Updated CHANGELOG.md
  • [7535de4] Fix sound velocity and add prechunking to builder (#688)
  • [39cb74f] rm emmet-core pin
  • [fc06393] Dockerfile: cp material/mpcule_resources.py
  • [b298ec0] Dockerfile: libopenblas-dev libjpeg62
  • [13467e8] upgrade dependencies for deployment
  • [3c2fdd0] Automated dependency upgrades (#687)
  • [c92ec00] explicitly pin emmet-core
  • [23717ed] upgrade dep: backtracking resolver
  • [06c9744] upgrade dependencies for deployment
  • [ca79271] bump python image 3.1010.1
  • [a4e3034] Automated dependency upgrades (#685)
  • [c033ef4] upgrade dependencies for deployment
  • [762cf2c] upgrade dependencies for deployment
  • [0bbf855] bump python image 3.1010.0
  • [e656c11] upgrade dependencies for deployment
  • [3cec3df] Automated dependency upgrades (#683)
  • [0a8a2da] upgrade dep: branch merge doesn't need python
  • [325a866] Merge branch 'main' of github.com:materialsproject/emmet into main
  • [8e319dd] cli: minor fixes for tasks.parsers
  • [d99d226] Updated CHANGELOG.md
  • [dd66ed1] Ensure material_id is in robocrys return data (#682)
  • [edb682e] cli: deal with reorg in tasks.backups
  • [15f33fb] Updated CHANGELOG.md
  • [27554a7] added entry_id mapping for reaction reactants and products (#675)
  • [6642acc] Automated dependency upgrades (#678)
  • [052790f] upgrade dependencies for deployment
  • [33fee8b] Updated CHANGELOG.md
  • [ba26f99] Fix phonon prechunking (#681)
  • [682fff8] Merge branch 'main' of github.com:materialsproject/emmet into main
  • [a1663f7] cli: add tasks.parsers command
  • [9da8372] Updated CHANGELOG.md
  • [83b9b95] Merge branch 'main' of github.com:materialsproject/emmet into main
  • [c929714] cli: try to resolve/cp symlinks first
  • [7e94661] cli: more efficient next_tid
  • [0b291b5] Add prechunking to phonon builder (#680)
  • [a4e118b] cli: rm launchers not files
  • [009c28b] cli: don't return warning for no launchers found
  • [637c6a7] cli: fix typo
  • [cb793b2] cli: better comment format
  • [e4ac2ee] cli: new tasks.backups command
  • [6335b43] Updated CHANGELOG.md
  • [0a7fa56] Use calcs_reversed data when available for params (#679)
  • [576bf55] cli: catch insertion exception
  • [9f33e7b] cli: use -L to create htar archive
  • [f333fae] cli: forward VaspDrone runs config to parse
  • [192e27b] cli: catch task-id not set error
  • [5f8655d] cli: catch EndpointConnectionError for MinIO
  • [77b1d81] cli: parse all volumetric data by default
  • [6bd7d61] upgrade dependencies for deployment
  • [537f102] Updated CHANGELOG.md
  • [09420d3] Merge atomate2 taskdoc (#676)
  • [0b07425] Updated CHANGELOG.md
  • [9cbab16] Automated dependency upgrades (#677)
  • [a974000] Fix mypy core issues
  • [81eaaff] upgrade dependencies for deployment
  • [ef7d3fe] Expanded MPcule API (#674)
  • [28dac94] bump python image 3.916.5
  • [9850608] upgrade dependencies for deployment
  • [23fc658] Automated dependency upgrades (#672)
  • [9cb7796] upgrade dependencies for deployment
  • [841f05e] Updated CHANGELOG.md
  • [229a1b1] Utils to static (#673)
  • [06796ff] upgrade dependencies for deployment
  • [822196d] Updated CHANGELOG.md
  • [a1e7baf] Include molecule endpoints in app.py (#671)
  • [0397eac] Updated CHANGELOG.md
  • [27727cd] Supress warning about transmuter in materials (#670)
  • [2e355b4] Updated CHANGELOG.md
  • [48e0f7b] Rename phonon input collection (#669)
  • [67d5603] bump python image 3.916.2
  • [91164b6] upgrade dependencies for deployment
  • [a4ee045] Automated dependency upgrades (#665)
  • [480a78b] upgrade dependencies for deployment
  • [fecfdb8] Updated CHANGELOG.md
  • [413378c] [WIP] Fix multi-solvent MPcule building (#664)
  • [f66e46e] Updated CHANGELOG.md
  • [0319ec9] Add thermo type consideration to alloy builder (#663)
  • [615a62b] Updated CHANGELOG.md
  • [3a2e585] [WIP] - MPcule API (#645)
  • [7d76516] Updated CHANGELOG.md
  • [9ba6350] Add 3.11 to pytest test matrix (#661)
  • [298b208] Automated dependency upgrades (#662)
  • [00b29ea] Fix mypy
  • [4891685] Add python 3.11 to dependency wflow
  • [7e8896a] Updated CHANGELOG.md
  • [87ddd9f] Add chemenv and absorption API endpoints (#660)
  • [bcbed57] upgrade dependencies for deployment
  • [b69c6b8] Automated dependency upgrades (#653)
  • [f8077d9] cli: always gzip files
  • [5c0e543] cli: add mol.qin as dir type
  • [e299393] Updated CHANGELOG.md
  • [944df5f] Conversion Electrode Builder (#597)
  • [3a4bef7] Updated CHANGELOG.md
  • [9f57061] Automated dependency upgrades (#652)
  • [1f4ee5b] Only enable linux testing
  • [9157120] Fix openbabel install in test workflow (#650)
  • [8ca7d5d] Automated dependency upgrades (#649)
  • [032d752] Unpin numpy in emmet-api
  • [831bd30] Unpin numpy
  • [65db8bb] Limit corrected entries and thermo (#644)
  • [5ff41fa] Molecules update (#440)
  • [aecefdd] Automated dependency upgrades (#642)
  • [5909d01] upgrade dependencies for deployment
  • [91e7bf6] Add deepcopy to entries in corrected_entries (#641)
  • [ec0984e] Force thermo builder to use max chemsys
  • [a022601] Add max chemsys option to thermo (#640)
  • [7629f7b] Lower on push release action version
  • [77483b9] Fix order of R2SCAN entry retrieval (#638)
  • [a07bda7] upgrade dependencies for deployment
  • [8301401] Automated dependency upgrades (#639)
  • [da7c08c] upgrade dependencies for deployment
  • [a146d58] Fix doc build action
  • [bfced4b] Make thermo last updated correspond to build time (#636)
  • [871e02b] Fix thermo doc updating (#635)
  • [9737617] upgrade dependencies for deployment
  • [e30a5bc] Automated dependency upgrades (#634)
  • [0cd4cca] Bump maggma
  • [ecc8555] Add last updated checking to corrected and thermo (#632)
  • [2765fdd] New CorrectedEntriesBuilder and ThermoBuilder changes (#631)
  • [12d8301] upgrade dependencies for deployment
  • [17bad22] Automated dependency upgrades (#630)
  • [1a18502] upgrade dependencies for deployment
  • [9fc8037] Automated dependency upgrades (#629)
  • [e899aea] Bump maggma
  • [e15b669] Automated dependency upgrades (#628)
  • [0c0c240] Bump maggma
  • [70ef25a] upgrade dependencies for deployment
  • [4ab83cd] upgrade dependencies for deployment
  • [a0c2cc8] upgrade dependencies for deployment
  • [2c490df] bump python image 3.915.9
  • [c452182] upgrade dependencies for deployment
  • [645d401] Automated dependency upgrades (#625)
  • [25d692f] bump python image 3.915.8
  • [df0094a] upgrade dependencies for deployment
  • [591a04d] Automated dependency upgrades (#623)
  • [6ce7212] Bump maggma
  • [939087f] bump python image 3.915.7
  • [5fc99a4] upgrade dependencies for deployment
  • [b6b4f9f] Automated dependency upgrades (#621)
  • [a017f67] upgrade dependencies for deployment
  • [ceb8ba2] Automated dependency upgrades (#619)
  • [ac27e06] Bump maggma
  • [fabf0b6] cli: fix import
  • [b286cc0] Automated dependency upgrades (#617)
  • [e40c251] Bump maggma
  • [0d78a62] Unpin openbabel
  • [39521f8] Pin openbabel to fix dep version
  • [d285cb2] emmet-core/setup.py remove upward pin of pymatgen + monty to below 2023.0 (#616)
  • [fdcc891] upgrade dependencies for deployment
  • [6c82e3a] cli: add VASP validation during parse
  • [fe503f7] cli: track already in HPSS during backup
  • [7daa093] cli: github3.authorize not supported anymore, mv mp_logging
  • [e3d66fb] Pin numpy in emmet-core
  • [c00e7e7] Numpy < 1.24
  • [a510e1c] Automated dependency upgrades (#613)
  • [869ec52] upgrade dependencies for deployment
  • [bbe7e38] upgrade dependencies for deployment
  • [2e1bac1] upgrade dependencies for deployment
  • [935f366] Automated dependency upgrades (#612)
  • [287db94] upgrade dependencies for deployment
  • [8399d34] upgrade dependencies for deployment
  • [d82dd9a] Automated dependency upgrades (#611)
  • [a588cb3] upgrade dependencies for deployment
  • [aa5a033] Automated dependency upgrades (#610)
  • [a2d057d] Bump maggma
  • [11127aa] Automated dependency upgrades (#609)
  • [0a13f80] upgrade dependencies for deployment
  • [6cd42ac] Automated dependency upgrades (#608)
  • [36f22b8] fixing "Optic" TaskType (#592)
  • [03eb343] Tolerance change no.2 (#574)
  • [632bfe1] Disable sort disk use in for s3 endpoints (#607)
  • [3fab9ba] upgrade dependencies for deployment
  • [0131016] Automated dependency upgrades (#606)
  • [c823fcf] upgrade dependencies for deployment
  • [01fae81] Automated dependency upgrades (#605)
  • [c8e7373] upgrade dependencies for deployment
  • [4f0e094] Automated dependency upgrades (#604)
  • [a969557] Automated dependency upgrades (#601)
  • [0d5c325] Bump maggma with api disk addition (#602)
  • [b91e5bb] upgrade dependencies for deployment
  • [30e93e6] upgrade dependencies for deployment
  • [0512355] Automated dependency upgrades (#600)
  • [dff67cc] Updated phonon builder (#599)
  • [38d26fe] upgrade dependencies for deployment
  • [bb3ccc4] Automated dependency upgrades (#598)
  • [e6ea3b5] upgrade dependencies for deployment
  • [d7dd596] ChemEnv only when oxidation states exist (#596)
  • [88358bc] use deployment req file
  • [ba68fdd] upgrade dependencies for deployment
  • [0e816de] Automated dependency upgrades (#594)
  • [7e7fb98] bump python image 3.915.1
  • [dc2cb46] api: fix Dockerfile
  • [1d4f286] bump python image 3.915.0
  • [a7ec2ee] Automated dependency upgrades (#593)
  • [3c5c693] fix upgrade action
  • [1d3c2a8] Change docs python version to 3.8 (#590)
  • [b8e9416] More flake8
  • [bfa6ba3] Flake8 fixes
  • [ad2ee66] Mypy fixes
  • [97ceea9] add openbabel install to docs action
  • [75bdb94] fix cache pip option
  • [69b6bca] rm docs reqs
  • [1bfcdad] Automated dependency upgrades (#591)
  • [cd0677b] rebase on github_ref; mkdocs-material<8.3
  • [0d11f17] Add doc reqs
  • [fb49dc8] rebase on origin/main
  • [2c145ec] Fix release wflow
  • [b90ef6c] skip 3.10 for now
  • [690c49d] use GITHUB_PATH
  • [0ba07d8] try installing numpy first
  • [005fb18] Automated dependency upgrades (#589)
  • [0860cd1] postpone tests for windows
  • [f4f017c] work on docs action
  • [87b51ac] 3.10 seems to pass all tests locally too
  • [d23c87a] core: fix test files path
  • [155ad23] add ubuntu and py39 back in
  • [3d404f0] fix test action typo
  • [1c9d2e7] be explicit with local install
  • [bf6d878] fix test dir paths
  • [18affc8] try non-editable for emmet-core as dependency
  • [cbdee94] try different folder structure for tests
  • [18c311b] try adding init to tests
  • [2e4ad88] add init for builders mobility
  • [4af73cf] Skip remaining emmet-core mol tests
  • [ee6cb32] Skip mol atomic tests
  • [6ec6f45] Skip mol builder tests
  • [f274432] add Dockerfile for testing
  • [885c7f2] use logger.warning
  • [50bb308] Temp skip ES tests
  • [58415b1] xfail emmet-core mol tests
  • [a027d55] also specific python for mypy and pytest
  • [db4a374] try pip install --user
  • [238dd17] skip 3.10 for now
  • [fea0059] --no-deps for emmet-core and fetch-depth 0
  • [a014488] be explicit with python versions
  • [e369c75] use pip cache for testing action
  • [df5c2cd] try brew/apt for openbabel
  • [6eeb732] Automated dependency upgrades (#588)
  • [730e6ad] all openbabel and wincertstore deps for testing
  • [e4464c7] testing: pip-sync --user
  • [9d48ffb] typo fix
  • [6acbd76] Add maggma to core test deps
  • [5984726] fix missing comma
  • [8e4b3a9] Update windows tests
  • [6691c47] Pip sync user
  • [69995a3] fix flake8 errors
  • [5749d8e] update testing action for pip-tools reqs
  • [ae84b35] pip-tools for docs requirements
  • [d6ec93b] Automated dependency upgrades (#587)
  • [000f275] dep upgrade action: add user config
  • [3eb4fe1] dep upgrade action: reduce matrix, fetch everything
  • [7c38105] dep upgrade action: fix indent
  • [224456b] dep upgrade action: use bash shell
  • [42608f1] dep ugrade action: add rebase to clean up
  • [23f366f] starting pull_request job for dep upgrade action
  • [f529aab] try fixing change detection again
  • [185405e] improve detect changes step
  • [a9da6be] minor update for dep upgrade action
  • [a4733c6] try different way to determine changes for upgrade dep
  • [b994c47] commit action only supported on linux
  • [a3c9150] fix dep upgrade os condition
  • [1781786] separate windows changes check for dep action
  • [dd3a487] push dep upgrades to separate branches
  • [97e6124] fix files option for dependency commit
  • [18d5315] hard-code dependency branch
  • [e2faa3a] fix branch name ref
  • [ea6a0eb] add test dep to extras_require
  • [6794107] add initial req files
  • [fa626bf] fix python versions
  • [6e3175c] remove req files
  • [339df8d] api: use pip-sync and pretend version in Dockerfile
  • [bec43c7] use pip-tools in testing action
  • [082c22c] use matrix to upgrade dependencies
  • [a96a0b9] no root-level req files
  • [a351dd3] emmet-builders pip-compile
  • [6ee5bb4] emmet-core pip-compile
  • [514aff3] Revert custom versioning
  • [63e4849] Updated CHANGELOG.md
  • [0b4eed6] Updated version file
  • [a15cf87] Updated version file
  • [d1a127a] Updated version file
  • [b81414b] Fix BS and DOS processing with missing fs_id (#575)
  • [c2ca7f5] Automated dependency upgrades (#583)
  • [3078372] add upgrade-dependencies action; switch core to pip-tools
  • [9131828] switch to uvicorn-tschaume and pip-tools
  • [bc01e43] api: revert to 3.9
  • [d15a52c] emmet-api: python path for 3.11
  • [f060ec3] bump python image 3.110.0
  • [64fbdbc] Updated CHANGELOG.md
  • [6a707ed] Updated version file
  • [c2c80af] Updated version file
  • [e89bc47] Updated version file
  • [2ce555e] Tolerance change (#572)
  • [10dc08c] bump python image 3.913.12
  • [8b4c2bc] Bump peaceiris/actions-gh-pages from 3.8.0 to 3.9.0
  • [48f5c11] Bump pymatgen from 2022.9.21 to 2022.10.22 in /emmet-core
  • [abd60c0] Updated CHANGELOG.md
  • [52c4a59] Updated version file
  • [b666655] Updated version file
  • [f82aec3] Updated version file
  • [7bdc3d4] Update polar test
  • [18f824c] Skip test
  • [a3ea7fc] Update spglib req
  • [3e64b4f] Force setuptools_scm to search parent dirs (#568)
  • [72c5b30] Updated CHANGELOG.md
  • [caa5992] Updated version file
  • [aef4bb9] Updated version file
  • [867e27e] Updated version file
  • [31a2262] Linting
  • [4e69599] Ensure pds dict is updated properly in ThermoBuilder (#567)
  • [e0ef5dc] Updated CHANGELOG.md
  • [99c42ee] Updated version file
  • [5ba6b58] Updated version file
  • [86bcc95] Updated version file
  • [d564566] Fix use of PatchedPhaseDiagram in ThermoBuilder (#566)
  • [f79b390] Fix pip install from source (#565)
  • [45dfaa2] Updated CHANGELOG.md
  • [47b2009] Updated version file
  • [b123374] Updated version file
  • [bb820c3] Updated version file
  • [94906dc] FIx PD chemsys (#563)
  • [b676f4b] Updated CHANGELOG.md
  • [071e6d5] Updated version file
  • [cf0c6ba] Updated version file
  • [732adb8] Updated version file
  • [93c42f2] Fix thermo builder and phase diagram generation (#562)
  • [eac92a3] Updated CHANGELOG.md
  • [7ad8b82] Updated version file
  • [cd1aa59] Updated version file
  • [5682834] Updated version file
  • [6e3ee61] Update thermo builder and API (#561)
  • [f4ee267] Bump shapely from 1.8.4 to 1.8.5.post1 in /emmet-api
  • [25b39fe] Bump fastapi from 0.85.0 to 0.85.1 in /emmet-api
  • [57cfc30] Bump ddtrace from 1.5.1 to 1.5.2 in /emmet-api
  • [d8c5cce] bump python image 3.913.10
  • [5175d1c] Bump ddtrace from 1.5.0 to 1.5.1 in /emmet-api
  • [b35ffc2] Update spglib requirement from <2.0.0 to <3.0.0 in /emmet-core
  • [1fb2346] Bump typing-extensions from 4.3.0 to 4.4.0 in /emmet-core
  • [0809c3a] Updated CHANGELOG.md
  • [18aa86f] Updated version file
  • [748f839] Updated version file
  • [64ca418] Updated version file
  • [6de45a8] Fix thermo key in summary (#554)
  • [56d683d] Updated CHANGELOG.md
  • [137110b] Updated version file
  • [c14f95c] Updated version file
  • [1776998] Updated version file
  • [3340019] Fix spglib req
  • [61a0fc6] Ensure proper treatment of static collections (#553)
  • [42c1c47] bump python image 3.913.10
  • [1a7b7f4] Updated CHANGELOG.md
  • [20953b5] Updated version file
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