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Issues list

VASP RunType is missing PBE_64/LDA_64

#1101 opened Sep 16, 2024 by janosh

[Feature Request]: Store the number of electronic steps taken per ionic step enhancement

#1065 opened Jul 31, 2024 by Andrew-S-Rosen

Bad force unit in VASP OutputDoc

#1035 opened Jun 16, 2024 by janosh

Q-Chem data is not always valid

#965 opened Mar 11, 2024 by matthewkuner

Changing how task_types are determined

#964 opened Mar 5, 2024 by matthewkuner

Bug: The .as_dict() method on CrystalSystem is not Monty compatible

#914 opened Dec 23, 2023 by Andrew-S-Rosen

[Feature Request]: Better handling of parsed trajectory in VASP calculations

#872 opened Oct 26, 2023 by gpetretto

[Feature Request]: Add missing py.typed file

#867 opened Oct 18, 2023 by Andrew-S-Rosen

Bug when parsing LDA pseudopotential

#847 opened Oct 6, 2023 by Andrew-S-Rosen

[Idea]: User-friendly access to properties

#840 opened Oct 3, 2023 by davidwaroquiers

Changing Elasticity builder to identify deformation calcs *not* using calc_type

#822 opened Sep 1, 2023 by matthewkuner

emmet-core requirement for openbabel not declared

#812 opened Aug 20, 2023 by drew-parsons

task_type incorrectly identifies NSCF Line calcs as Uniform calcs

#800 opened Aug 3, 2023 by matthewkuner

NELMDL mispelled, check not accurate

#795 opened Jul 26, 2023 by matthewkuner

[DISCUSSION] Validating INCAR parameters for external VASP calculations discussion

New feature discussions

#772 opened Jul 6, 2023 by matthewkuner

Add documentation badge or link to README

#757 opened Jun 16, 2023 by rkingsbury

Merging atomate2 calc_types schema

#735 opened May 20, 2023 by mjwen

SymmetryData for structures is missing a few pydantic field descriptions

#734 opened May 19, 2023 by Andrew-S-Rosen

Maximum recursion depth exceeded for py>=3.9

#717 opened May 8, 2023 by marcodigennaro

Content type headers not properly set in API responses bug

#702 opened Apr 24, 2023 by munrojm

Integrate Matscholar Fast API into MP API server

#637 opened Feb 1, 2023 by tschaume

el_refs serialized as strings bug

#576 opened Oct 27, 2022 by jmmshn

formula autocomplete: tuple index out of range

#407 opened Apr 27, 2022 by tschaume

out of range float values not JSON compliant bug

#406 opened Apr 27, 2022 by tschaume

Properly populate deprecation_reason in materials builder from task validation output

#383 opened Mar 25, 2022 by munrojm

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