Atomate Atomate2
Topic | Replies | Views | Activity | |
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About the Atomate2 category
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0 | 247 | May 19, 2022 | |
General question on mock VASP
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1 | 232 | November 14, 2023 | |
Atomate2 pymongo.errors.OperationFailure
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2 | 204 | October 16, 2023 | |
Compatibility of pymatgen.analysis.defects with atomate2
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0 | 223 | August 23, 2023 | |
Document size to large for MongoDB
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1 | 302 | August 9, 2023 | |
I need help using atomate2 on a remote cluster
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0 | 377 | March 31, 2023 | |
Insert material project material id into final job/flow output in Atomate2
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1 | 417 | March 28, 2023 | |
Proper hostname for NERSC-hosted MongoDB (Atomate2 setup)
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0 | 347 | February 3, 2023 | |
Possible rework for object storage in addtional stores
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0 | 430 | November 28, 2022 | |
Proper usage of "name" field
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4 | 425 | November 28, 2022 | |
Backfill database with historical vasp runs?
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2 | 341 | October 24, 2022 | |
[atomate2] parsing of f orbitals in dos
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2 | 439 | May 23, 2022 |