basisopt
Automatic basis set optimization for quantum chemistry
- Latest release
- Jun 27, 2025
- Releases
- 4
- Known CVEs
- 0
- First release
- Mar 14, 2023
- License
- MIT
Insights
Activity
- Total releases
- 4
- Last 12 months
- 0
- Cadence
- ~3 days
- Dependencies
- 8
Releases per month
last 12 monthsRelease mix
- patch 1
- pre 2
4
releases
Dependencies
Depends on
1.0.1a0-
basis-set-exchange
<0.10,>=0.9
-
colorlog
<7.0.0,>=6.7.0
-
matplotlib
<4.0.0,>=3.7.1
-
mendeleev
==0.9
-
monty
<2023.0.0,>=2022.9.9
-
numpy
<2.0.0,>=1.24.2
-
pandas
<2.0.0,>=1.5.3
-
scipy
<2.0.0,>=1.10.1
Used by
Nothing tracked depends on this yet.
Releases
| Version | Released | |
|---|---|---|
1.0.1a0
pre
|
1.0.1a0
pre
Dependencies (8)
|
|
1.0.1
patch
|
1.0.1
patch
|
|
1.0.0
initial
|
1.0.0
initial
|
|
1.0.0a0
pre
|
1.0.0a0
pre
|