| Name | Version | Summary | date |
| amset |
0.4.20 |
AMSET is a tool to calculate carrier transport properties from ab initio calculation data |
2023-08-24 20:25:33 |
| dqclibs |
0.1.1 |
Libraries for DQC |
2023-07-05 11:17:43 |
| aiida-fleur |
2.0.0 |
AiiDA Plugin for running the FLEUR code and its input generator. Also includes high-level workchains and utilities |
2023-05-03 19:47:08 |
| masci-tools |
0.15.0 |
masci-tools is a collection of tools for materials science. |
2023-05-03 14:20:28 |
| TESTE-topologic |
0.0.1 |
... |
2023-04-14 13:11:18 |
| kpLib |
1.1.1 |
Library for generating highly-efficient generalized Monkhorst-Pack K-point grids to accelerate electronic structure calculations, like DFT. |
2023-04-09 05:10:53 |
| qdft |
0.5 |
Constant-Q Sliding DFT |
2023-01-28 22:17:20 |
| sdft |
1.4 |
Forward and inverse Sliding Discrete Fourier Transform (Sliding DFT) |
2023-01-15 11:32:38 |
| minflow |
0.0.1 |
A basic package for a customized workflow using quantum espresso or abinit. |
2023-01-05 17:31:13 |
| mdf-forge |
0.8.0 |
Materials Data Facility python package |
2022-05-09 21:12:35 |