GitHub topics: atomic-modeling
evulan/GPR-HAT-barrier-prediction
Code used to predict hydrogen atom transfer (HAT) energy barriers using Gaussian Process Regression
Language: Python - Size: 921 KB - Last synced at: 4 months ago - Pushed at: 4 months ago - Stars: 1 - Forks: 0
sabamadadi/10-Chemistry-Codes
Chemistry + Python
Language: Python - Size: 2.29 MB - Last synced at: 10 months ago - Pushed at: 10 months ago - Stars: 0 - Forks: 0
haoran-ni/MasterThesis
Original codes of my master thesis
Language: Jupyter Notebook - Size: 14.9 MB - Last synced at: about 2 years ago - Pushed at: almost 3 years ago - Stars: 0 - Forks: 1
