GitHub topics: statistical-thermodynamic
Mauro-Prencipe/QM-thermodynamics
Computation of thermodynamic properties of crystals from ab initio calculation of static energies and vibrational frequencies.
Language: Jupyter Notebook - Size: 4.96 MB - Last synced at: about 2 months ago - Pushed at: about 2 months ago - Stars: 0 - Forks: 0
LESC-Unicamp/Monte-Carlo-Mixtures-of-Ellipsoids-Spherocylinders-Cylinders
This is a NVT/NPT-Monte Carlo algorithm designed to evaluate the thermodynamic behavior of mixtures of some hard convex bodies: ellipsoids of revolution, spherocylinders, and cylinders.
Language: Fortran - Size: 1020 KB - Last synced at: 2 months ago - Pushed at: 2 months ago - Stars: 2 - Forks: 1
lexin-chen/StatThermo
stat thermo concepts in code
Language: Jupyter Notebook - Size: 2.22 MB - Last synced at: about 1 year ago - Pushed at: almost 2 years ago - Stars: 2 - Forks: 0
