piwheels

atomate2

atomate2 is a library of materials science workflows

Installation

In a virtualenv (see these instructions if you need to create one):

pip3 install atomate2

Dependencies

• pyyaml
• jobflow
• pydantic-settings
• click
• emmet-core
• custodian
• numpy
• pydantic
• monty
• pymatgen
• pymongo

Releases

Version	Released	Bookworm Python 3.11	Trixie Python 3.13	Files
0.1.5	2026-07-13
atomate2-0.1.5-py3-none-any.whl (546 KB)
0.1.4	2026-05-11
atomate2-0.1.4-py3-none-any.whl (540 KB)
0.1.3	2026-05-05
atomate2-0.1.3-py3-none-any.whl (527 KB)
0.1.2	2026-04-25
atomate2-0.1.2-py3-none-any.whl (526 KB)
0.1.1	2026-04-03
atomate2-0.1.1-py3-none-any.whl (525 KB)
0.1.0	2026-03-31
atomate2-0.1.0-py3-none-any.whl (525 KB)
0.0.23	2025-12-03
atomate2-0.0.23-py3-none-any.whl (491 KB)
0.0.22	2025-10-14
atomate2-0.0.22-py3-none-any.whl (490 KB)
0.0.22rc1 pre-release	2025-08-28
atomate2-0.0.22rc1-py3-none-any.whl (486 KB)
0.0.21	2025-06-05
0.0.20	2025-04-25
atomate2-0.0.20-py3-none-any.whl (463 KB)
0.0.19	2025-01-31
atomate2-0.0.19-py3-none-any.whl (448 KB)
0.0.18	2024-11-12
atomate2-0.0.18-py3-none-any.whl (444 KB)
0.0.17	2024-09-30
atomate2-0.0.17-py3-none-any.whl (415 KB)
0.0.16	2024-09-26
atomate2-0.0.16-py3-none-any.whl (414 KB)
0.0.15	2024-08-20
atomate2-0.0.15-py3-none-any.whl (352 KB)
0.0.14	2024-02-29
atomate2-0.0.14-py3-none-any.whl (278 KB)
0.0.13	2024-01-08
atomate2-0.0.13-py3-none-any.whl (227 KB)
0.0.12	2023-10-30
atomate2-0.0.12-py3-none-any.whl (217 KB)
0.0.11	2023-09-02
atomate2-0.0.11-py3-none-any.whl (204 KB)
0.0.10	2023-03-12
atomate2-0.0.10-py3-none-any.whl (163 KB)
0.0.9	2023-03-08
atomate2-0.0.9-py3-none-any.whl (150 KB)
0.0.8	2022-10-04
atomate2-0.0.8-py3-none-any.whl (140 KB)
0.0.7	2022-05-05
0.0.6	2022-02-07
atomate2-0.0.6-py3-none-any.whl (117 KB)
0.0.5	2022-01-26
atomate2-0.0.5-py3-none-any.whl (112 KB)
0.0.4	2021-12-23
atomate2-0.0.4-py3-none-any.whl (110 KB)
0.0.3	2021-11-10
atomate2-0.0.3-py3-none-any.whl (95 KB)
0.0.2	2021-11-02
atomate2-0.0.2-py3-none-any.whl (91 KB)
0.0.1	2021-11-02
atomate2-0.0.1-py3-none-any.whl (91 KB)

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