piwheels

quacc

A platform to enable high-throughput, database-driven quantum chemistry and computational materials science

Installation

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

pip3 install quacc

Dependencies

• custodian
• frozendict
• ruamel-yaml
• emmet-core
• pydantic
• ase
• monty
• numpy
• pydantic-settings
• typer
• psutil
• pymatgen

Releases

Version	Released	Bullseye Python 3.9	Bookworm Python 3.11	Trixie Python 3.13	Files
1.0.3	2025-08-25
quacc-1.0.3-py3-none-any.whl (193 KB)
1.0.2	2025-08-24
quacc-1.0.2-py3-none-any.whl (191 KB)
1.0.1	2025-08-22
quacc-1.0.1-py3-none-any.whl (191 KB)
1.0.0	2025-08-20
quacc-1.0.0-py3-none-any.whl (191 KB)
0.17.1	2025-08-12
quacc-0.17.1-py3-none-any.whl (190 KB)
0.17.0	2025-07-28
quacc-0.17.0-py3-none-any.whl (190 KB)
0.16.0	2025-06-11
quacc-0.16.0-py3-none-any.whl (189 KB)
0.15.5	2025-06-05
quacc-0.15.5-py3-none-any.whl (189 KB)
0.15.4	2025-06-01
quacc-0.15.4-py3-none-any.whl (189 KB)
0.15.3	2025-05-29
quacc-0.15.3-py3-none-any.whl (189 KB)
0.15.2	2025-05-25
quacc-0.15.2-py3-none-any.whl (189 KB)
0.15.1	2025-05-22
quacc-0.15.1-py3-none-any.whl (189 KB)
0.15.0	2025-05-12
quacc-0.15.0-py3-none-any.whl (189 KB)
0.14.0	2025-04-27
quacc-0.14.0-py3-none-any.whl (189 KB)
0.13.0	2025-03-17
quacc-0.13.0-py3-none-any.whl (191 KB)
0.12.3	2025-03-03
quacc-0.12.3-py3-none-any.whl (190 KB)
0.12.2	2025-02-24
quacc-0.12.2-py3-none-any.whl (190 KB)
0.12.1	2025-02-11
quacc-0.12.1-py3-none-any.whl (190 KB)
0.12.0	2025-02-08
quacc-0.12.0-py3-none-any.whl (189 KB)
0.11.18	2025-02-07
quacc-0.11.18-py3-none-any.whl (189 KB)
0.11.17	2025-02-07
quacc-0.11.17-py3-none-any.whl (189 KB)
0.11.16	2025-02-06
quacc-0.11.16-py3-none-any.whl (189 KB)
0.11.15	2025-02-05
quacc-0.11.15-py3-none-any.whl (189 KB)
0.11.14	2025-01-29
quacc-0.11.14-py3-none-any.whl (189 KB)
0.11.13	2025-01-15
quacc-0.11.13-py3-none-any.whl (189 KB)
0.11.10	2025-01-05
quacc-0.11.10-py3-none-any.whl (179 KB)
0.11.9	2024-12-30
quacc-0.11.9-py3-none-any.whl (179 KB)
0.11.8	2024-12-23
quacc-0.11.8-py3-none-any.whl (179 KB)
0.11.7	2024-10-11
quacc-0.11.7-py3-none-any.whl (179 KB)
0.11.6	2024-09-19
quacc-0.11.6-py3-none-any.whl (178 KB)
0.11.5	2024-09-17
quacc-0.11.5-py3-none-any.whl (178 KB)
0.11.4	2024-09-09
quacc-0.11.4-py3-none-any.whl (176 KB)
0.11.3	2024-08-16
quacc-0.11.3-py3-none-any.whl (176 KB)
0.11.2	2024-08-13
quacc-0.11.2-py3-none-any.whl (176 KB)
0.11.1	2024-08-13
quacc-0.11.1-py3-none-any.whl (175 KB)
0.11.0	2024-07-31
quacc-0.11.0-py3-none-any.whl (179 KB)
0.10.1	2024-07-13
quacc-0.10.1-py3-none-any.whl (178 KB)
0.10.0	2024-07-03
quacc-0.10.0-py3-none-any.whl (177 KB)
0.9.5	2024-06-16
quacc-0.9.5-py3-none-any.whl (175 KB)
0.9.4	2024-06-15
quacc-0.9.4-py3-none-any.whl (175 KB)
0.9.3	2024-06-12
quacc-0.9.3-py3-none-any.whl (175 KB)
0.9.2	2024-06-06
quacc-0.9.2-py3-none-any.whl (174 KB)
0.9.1	2024-05-31
quacc-0.9.1-py3-none-any.whl (174 KB)
0.9.0	2024-05-23
quacc-0.9.0-py3-none-any.whl (174 KB)
0.8.0	2024-05-12
quacc-0.8.0-py3-none-any.whl (174 KB)
0.7.8	2024-05-09
quacc-0.7.8-py3-none-any.whl (174 KB)
0.7.7	2024-04-23
quacc-0.7.7-py3-none-any.whl (174 KB)
0.7.6	2024-04-20
quacc-0.7.6-py3-none-any.whl (173 KB)
0.7.5	2024-04-16
quacc-0.7.5-py3-none-any.whl (172 KB)
0.7.4	2024-04-12
quacc-0.7.4-py3-none-any.whl (172 KB)
0.7.3	2024-04-09
quacc-0.7.3-py3-none-any.whl (172 KB)
0.7.2	2024-03-26
quacc-0.7.2-py3-none-any.whl (170 KB)
0.7.1	2024-03-20
quacc-0.7.1-py3-none-any.whl (170 KB)
0.7.0	2024-03-12
quacc-0.7.0-py3-none-any.whl (168 KB)
0.6.10	2024-03-07
quacc-0.6.10-py3-none-any.whl (167 KB)
0.6.9	2024-03-03
quacc-0.6.9-py3-none-any.whl (167 KB)
0.6.8	2024-03-01
quacc-0.6.8-py3-none-any.whl (163 KB)
0.6.7	2024-02-22
quacc-0.6.7-py3-none-any.whl (160 KB)
0.6.6	2024-02-13
quacc-0.6.6-py3-none-any.whl (160 KB)
0.6.5	2024-02-10
quacc-0.6.5-py3-none-any.whl (160 KB)
0.6.4	2024-02-02
quacc-0.6.4-py3-none-any.whl (171 KB)
0.6.3	2024-01-30
quacc-0.6.3-py3-none-any.whl (170 KB)
0.6.2	2024-01-22
quacc-0.6.2-py3-none-any.whl (163 KB)
0.6.1	2024-01-16
quacc-0.6.1-py3-none-any.whl (163 KB)
0.6.0	2024-01-12
quacc-0.6.0-py3-none-any.whl (161 KB)
0.5.2	2024-01-06
quacc-0.5.2-py3-none-any.whl (156 KB)
0.5.1	2024-01-05
quacc-0.5.1-py3-none-any.whl (155 KB)
0.5.0	2023-12-29
quacc-0.5.0-py3-none-any.whl (158 KB)
0.4.6	2023-12-18
quacc-0.4.6-py3-none-any.whl (148 KB)
0.4.5	2023-12-14
quacc-0.4.5-py3-none-any.whl (147 KB)
0.4.4	2023-12-11
quacc-0.4.4-py3-none-any.whl (133 KB)
0.4.3	2023-12-10
quacc-0.4.3-py3-none-any.whl (114 KB)
0.4.2	2023-12-04
quacc-0.4.2-py3-none-any.whl (114 KB)
0.4.1	2023-11-15
quacc-0.4.1-py3-none-any.whl (110 KB)
0.4.0	2023-11-09
quacc-0.4.0-py3-none-any.whl (110 KB)
0.3.13	2023-11-03
quacc-0.3.13-py3-none-any.whl (104 KB)
0.3.12	2023-11-01
quacc-0.3.12-py3-none-any.whl (104 KB)
0.3.11	2023-10-25
quacc-0.3.11-py3-none-any.whl (99 KB)
0.3.10	2023-10-25
quacc-0.3.10-py3-none-any.whl (99 KB)
0.3.9	2023-10-25
quacc-0.3.9-py3-none-any.whl (99 KB)
0.3.8	2023-10-24
quacc-0.3.8-py3-none-any.whl (98 KB)
0.3.7	2023-10-19
quacc-0.3.7-py3-none-any.whl (99 KB)
0.3.6	2023-10-11
quacc-0.3.6-py3-none-any.whl (103 KB)
0.3.5	2023-10-07
quacc-0.3.5-py3-none-any.whl (102 KB)
0.3.4	2023-10-06
quacc-0.3.4-py3-none-any.whl (103 KB)
0.3.3	2023-10-04
quacc-0.3.3-py3-none-any.whl (102 KB)
0.3.2	2023-10-04
quacc-0.3.2-py3-none-any.whl (102 KB)
0.3.1	2023-09-27
quacc-0.3.1-py3-none-any.whl (102 KB)
0.3.0	2023-09-26
quacc-0.3.0-py3-none-any.whl (102 KB)
0.2.8	2023-09-25
quacc-0.2.8-py3-none-any.whl (100 KB)
0.2.7	2023-09-20
quacc-0.2.7-py3-none-any.whl (100 KB)
0.2.6	2023-09-11
quacc-0.2.6-py3-none-any.whl (99 KB)
0.2.5	2023-09-04
quacc-0.2.5-py3-none-any.whl (97 KB)
0.2.4	2023-09-02
quacc-0.2.4-py3-none-any.whl (98 KB)
0.2.3	2023-09-01
quacc-0.2.3-py3-none-any.whl (96 KB)
0.2.2	2023-08-25
quacc-0.2.2-py3-none-any.whl (83 KB)
0.2.1	2023-08-25
quacc-0.2.1-py3-none-any.whl (182 KB)
0.0.2	2022-02-16
quacc-0.0.2-py3-none-any.whl (2 MB)
0.0.1	2022-02-08
quacc-0.0.1-py3-none-any.whl (2 MB)

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