usnistgov/COSMOSAC

View on GitHub

A Benchmark Implementation of COSMO-SAC

Stars: 90
Forks: 43
Open beginner issues: 0
Indexed issues: 12

Dominant language: HTML
License: MIT
Last GitHub push: Jul 3, 2026
Latest indexed: Sep 19, 2026
Contributing guide: No contributing guide
Code of conduct: No code of conduct
Beginner labels: No beginner labels indexed
PR merge metrics: No merged PRs in 30d

Beginner friendly Everything

Open All

12 open issues indexed

Some problems about dispersion term with code Open

Difficulty 5/5 Over a week Newbie friendliness 25/100

usnistgov/COSMOSAC#38 · Opened Mar 29, 2025
Problems with example script (missing attributes in module cCOSMO) Open

Difficulty 3/5 1-2 days Newbie friendliness 30/100

usnistgov/COSMOSAC#37 · 3 comments · Opened Feb 23, 2025
p(sigma) in VT-2005 Open

Difficulty 3/5 1-2 days Newbie friendliness 25/100

usnistgov/COSMOSAC#33 · 4 comments · Opened Dec 23, 2024
Zwitterions // Quaternary nitrogens Open

Difficulty 5/5 Over a week Newbie friendliness 25/100

usnistgov/COSMOSAC#32 · 3 comments · Opened Dec 16, 2024
Inquiry on Extending Sigma Profile Range and Calculating Ionic States Open

Difficulty 5/5 Over a week Newbie friendliness 25/100

usnistgov/COSMOSAC#31 · 3 comments · Opened Oct 8, 2024
E(misfit), E(hb), E(vdW) and E(Int) Open

Difficulty 4/5 3-5 days Newbie friendliness 25/100

usnistgov/COSMOSAC#29 · 7 comments · Opened Jun 24, 2023
GAMESS input Open

Difficulty 4/5 3-5 days Newbie friendliness 25/100

usnistgov/COSMOSAC#23 · 16 comments · Opened Jul 28, 2022
Adding new sigma profile Open

Difficulty 5/5 Over a week Newbie friendliness 25/100

usnistgov/COSMOSAC#20 · 19 comments · Opened Mar 26, 2022
What is a correct .cosmo file style Open

Difficulty 4/5 3-5 days Newbie friendliness 25/100

usnistgov/COSMOSAC#14 · 24 comments · Opened May 26, 2021
Calculation of activity coefficients for mixed systems containg ionic liquids Open

Difficulty 5/5 Over a week Newbie friendliness 20/100

usnistgov/COSMOSAC#13 · 2 comments · 1 reaction · Opened Apr 26, 2021
Issues with getting cosmo files from DMOL3 Open

Difficulty 5/5 Over a week Newbie friendliness 20/100

usnistgov/COSMOSAC#10 · 1 comment · 1 reaction · Opened Oct 7, 2020
Dispersion Contribution to Overall Activity Coefficient: Multi-Component Mixtures Open

Difficulty 5/5 Over a week Newbie friendliness 20/100

usnistgov/COSMOSAC#3 · 3 comments · Opened Jun 26, 2020

usnistgov/COSMOSAC

Get new issues in your inbox