v0.39.4

Version 0.39.4

Commits

• [09bdd4f] Limit parallel queries to 4 threads (#877)

v0.39.3

Version 0.39.3

Commits

• [0a1561a] Update max values in settings (#875)
• [5351c9b] Switch user-agent to mp-api version (#874)
• [39eb023] Fix client tests
• [2bebfa3] Dynamically instantiate MPContribs client (#870)
• [fec167e] Bump emmet-core
• [32ef4dd] Add sort back to messages
• [2af2749] Remove sort parameters from resters (#864)
• [d5240c5] Update elasticity material id query param
• [f380b4e] Switch elasticity rester key (#862)
• [22cd236] Linting
• [6cde233] Transition elasticity rester to new doc
• [5324d52] Fix structure test
• [1845d1e] Merge branch 'main' of https://github.com/materialsproject/api
• [f58511d] Fix eos test
• [9a971c2] Read API key from pymatgen config (#856)
• [47fc608] Fix pydantic deserialization issues with root obj (#854)
• [cc97851] patch agreed_terms field for user settings (#853)
• [6215e93] Automated dependency upgrades (#852)
• [9f89319] Set maggma lower bound
• [e069065] Automated dependency upgrades (#851)
• [83b27a0] Clarify top level get_entries method (#848)
• [ff7f643] Pydantic 2 support (#847)
• [ffd9713] Add arg to mute progress bars (#844)
• [63adcdf] Lazy loading and caching (#842)
• [6c40f72] Automated dependency upgrades (#843)
• [07f9bd9] Fix dep upgrade wflow
• [f82a3df] Update minimum python version
• [7109a44] Update build wflow
• [57d8acf] General repo and tooling cleanup (#839)
• [f8cfd82] Linting
• [0a2c36d] Optional botocore
• [7cbf363] use create_user_settings for new users posting settings for the first time (#837)
• [5f15be1] Keep boto3 optional (#836)
• [2352288] Update setup.py
• [01983ca] Update setup.py
• [46cb50e] Nest all resters (#833)
• [3855505] Update docs link
• [b2431e8] replace method post with patch for user setting to avoid wiping out certain fields (#829)
• [b2f2bc0] fix MPRester doc string for notify_db_version (#746)
• [f0fb74a] Revert pmg bump
• [68f769b] Bump pmg
• [1989f03] Add sorting and projecting to private resters (#826)
• [c32d071] Remove existing warning
• [98443a0] Merge branch 'main' of https://github.com/materialsproject/api
• [da0f4df] Add warning when accessing new molecules data
• [bf5bfee] Accommodate cloudflare errors (#823)
• [8709dec] add a patch method to update the message_last_read field in _user_set… (#821)
• [a1512bb] Automated dependency upgrades (#822)
• [5da8ed2] unsigned boto3 (#818)
• [928a696] Linting
• [8f0358a] Fix de-serlization of dos object
• [bf390c7] Integrate AWS open data buckets (#815)
• [f7e2a4e] Automated dependency upgrades (#816)
• [de162d5] Merge branch 'main' of https://github.com/materialsproject/api
• [d5fb390] Add messages client and 400,404 warnings
• [9976131] Fix molecules summary tests
• [3e514cf] Overload model dict to fix monty dumping (#813)
• [04f0662] Add 504 and 502 responses to retry settings
• [e4a0734] New molecules resters (#803)
• [3ffecd2] get_ion_reference_data_for_chemsys: fix bug in str chemsys (#756)
• [a7097c7] Automated dependency upgrades (#800)
• [9e5be9f] More test fixes
• [307e9db] Fix traj test
• [6e225dc] More chemenv test fixes
• [5997ff5] Fix chemenv test
• [e5b6e17] Linting
• [138057f] Fix setup
• [37763cb] Add testing reqs
• [06e4f4e] Fix gh token
• [3cb5d68] Fix git add
• [a321cb0] Fix req file references
• [3555dd2] Initial commit of req files
• [1876881] Don't treat as namespace
• [94a30fd] Add dependency wflow (#793)
• [aa93193] Update chemenv documetation and suggestions (#771)
• [68d54df] Fix MPRester attr mapping (#791)
• [c148ac2] Remove repeated setting (#790)
• [1defa9a] Remove dependabot and fix emmet dep
• [e878b9e] Unpin emmet-core
• [570dbfc] Add materials route nesting (#787)
• [d5190ff] Disable nested monty decode for some data (#784)
• [6316599] Ruff (#772)
• [53d30d8] Chemenv rester (#770)
• [e298b17] Make top level convenience method default to gga_gga_U
• [6ae15fd] Remove default thermo type in rester (#768)
• [1e1c377] Add new absorption rester (#765)
• [410627e] Fix dynamic model getattr (#764)
• [f5055d0] Pin emmet core to fix task doc validation
• [7aceb53] Fix material rester tests (#760)
• [dd9c5db] Small edit to add backoff_factor to client (#759)
• [858409f] Default API key value to None in MPRester (#743)
• [2ec98bd] Allow thermo_type string passing for phase diagram method (#742)
• [9dc27dc] add duplicate element checking in MPRester.get_entries_in_chemsys (#736)
• [0713f8c] Accept list[str] for thermo_types in ThermoRester.search() (#729)
• [1e83e2b] Ensure PhaseDiagram qhull_data is a numpy array (#731)
• [ece1b3e] Fix el_refs dict keys in PhaseDiagram objects (#730)
• [98eb360] Set default thermo_type in thermo search method (#726)
• [15c378b] use query_contributions for ion ref data
• [bebe77b] formatting; 32 apikey length
• [02e322f] Fix session typo
• [5ef9313] FIx order of input chemsys for pd search (#719)
• [8f21dbb] Fix passing session and headers in base rester (#717)
• [ac4bb36] Custom sessions (#716)
• [6bf1791] Header dictionary pass through and BaseRester nesting fix (#715)
• [49fc74a] Update thermo rester methods (#714)
• [fecf7fd] Fix robocrys search pagination (#712)
• [bc5a9fb] Add task_id list and elements to task search method (#709)
• [80f4686] Allow the pmgrc file to be read for the MPREster settings (#708)
• [574cda5] Fix charge density task_ids list query (#707)
• [17dd2cc] Implement method to get NOMAD download URL (#702)
• [ebe7c43] Insert missing comma in setup.py (#697)
• [d3f7687] Smart chunk with max URL length consideration (#695)
• [72eafaa] Add back additional_criteria as an input to get_entries and get_entries_in_chemsys (#693)
• [2292fc1] Ensure parity with top level legacy methods (#691)
• [25b21d8] Use six API keys in testing workflow instead of one (#687)
• [9f821a1] Remove manual dispatch from release wflow (#686)
• [f94a4fb] Fix wflow dispatch
• [045f94e] Fix release wflow
• [9913239] Add sphinx docs (#684)
• [89b37a6] Bump emmet (#679)
• [0b4520f] Remove pytest.mark.xfail decorator, test expected to pass
• [2849726] use latest actions/setup-python and actions/checkout (#678)
• [f29b2e0] support single values as search filters (#672)
• [3f97dec] Adding msgpack to requirements
• [6b9ebdf] Add msgpack to reqs (#671)
• [12c9371] Bump emmet-core (#670)
• [5057437] Temp ignore task test
• [7b9b3e1] Clean up dependencies (#666)
• [9ec0a9d] Only run MPDataDoc factory once per chunk (#665)
• [22501cd] Fix typo (#662)
• [fd5fb59] Add MPRestError import to root (#661)
• [f1b1b28] Fix wheels install (#660)
• [ebd426d] Namespace package, material_ids parameters (#659)
• [394fc4c] Raise attribute error for MPDataDoc (#658)
• [2856653] Add custodian as a dependency (#656)
• [be24667] Enhance output objects (#654)
• [ef951a2] disable requests.Session.trus_env on default (#648)
• [996324f] Add exclude elements to list of non-parallel (#649)
• [9aa0b28] Add convenience method for AlloysRester (#647)
• [05dd0c0] Add timeout to get requests (#646)
• [3850b80] Bump maggma to fix pydantic model sanitization (#644)
• [7d25a40] Add AlloyRester (#643)
• [9f99e6d] Bump emmet core (#641)
• [341ff2c] Bump emmet and maggma (#638)
• [96eaabb] Bump emmet and update reference to legacy elasticity (#620)
• [3ea2f4b] Fix edge and spectrum type in xas client (#619)
• [250f51c] Enhance usability (#506)
• [865f33f] Fix molecules import (#607)
• [efb161e] Pourbaix: fix filtering extra elements (#606)
• [6e4da02] Update molecules doc import (#598)
• [89de344] Add client side checks on material and task IDs (#589)
• [a4933b5] Fix unsiged S3 configuration when using in deployment (#583)
• [683ec9d] Ensure bucket name is present for AWS deployment (#582)
• [2db0b6a] Use boto3 instead of direct get requests in client for charge density data (#581)
• [a87971f] Change s3 timeout values (#580)
• [99e811a] Check for AWS deployment in CHGCAR lookup (#579)
• [047d832] Band structure, DOS, and charge density changes (#577)
• [1e96481] Update prefixed query params (#571)
• [b877ae9] Add minimal API key validation (#572)
• [46d83aa] Fix MPRester import in core client (#567)
• [32c45ba] Update README.md
• [64c229b] Fix electrode test
• [6785935] Update reqs
• [77f4af7] Bump maggma from 0.40.0 to 0.44.1 (#551)
• [e08de40] Bump emmet-core from 0.21.19 to 0.21.20 (#540)
• [d1a79a5] Add back windows testing
• [9a9ce39] Bump pymatgen (#550)
• [d5e0a47] Update testing pipelines
• [c293b66] Ensure proper env var (#546)
• [bc3094c] Mute progress bars with MUTE_PROGRESS_BARS env variable (#545)
• [d64c402] Try additional operating systems in testing matrix
• [2b8cba3] task_id to material_id in xas search (#544)
• [8eecf9e] Bump mpcontribs
• [2c04bf7] Fix trajectory convenience function (#542)
• [aeefde8] Include response handling in multithreading (#538)
• [eaae661] LImit synthesis tests
• [d4bce7b] Use reference solids to construct the ion reference phase diagram (#533)
• [7ce7c4c] Fix task_id return when no calc_types given (#527)
• [951d17b] more dependabot PRs
• [b13ce17] dependabot PRs
• [3418c5c] remove docker remnants
• [587fbe6] Change max paralle in test wflow (#505)
• [ebd7403] Remove heartbeat slash (#504)
• [4377f11] Format endpoint in MPRester (#502)
• [2f2c5f8] Fix reqs (#501)
• [560706e] Enhance parallel requests and bug fixes (#496)
• [667848e] Move server side code to emmet-api package and parallel requests (#475)
• [2796143] Update requirements.txt
• [480f925] Fix typo
• [7c71437] Remove server reqs
• [ed581fd] dependabot PRs
• [f9da02f] dependabot PRs
• [6dae97f] bump python image 3.97.10
• [a42bb3c] Bump boto3 from 1.20.26 to 1.20.27
• [2a1c21a] dependabot PRs
• [e32114e] Chemsys added to electrodes (#468)
• [a286586] Split formula chemsys (#467)
• [3e1070c] Merge remote-tracking branch 'origin/dependabot/pip/boto3-1.20.25'
• [7ded0a7] Emmet bump (#466)
• [8791b61] Li...

v0.39.2

Update user agent data

v0.39.1

MPContribs client is not dynamically instantiated in MPRester

v0.39.0

Removal of server-side sorting

v0.39.0rc2

Bug fix with messages rester and sorting

v0.39.0rc1

All sorting fields removed

v0.38.0

Updates to allow querying of new elasticity data

v0.38.0rc2

More elasticity bug fixes

v0.38.0rc1

Elasticity release candidate