ComputationalPhysics2

ComputationalPhysics2 copied to clipboard

Hi, Related with the previous bug report, I was looking over this page: http://compphysics.github.io/ComputationalPhysics2/doc/pub/vmc/html/vmc-bs.html I noticed some issues in the python code. I think that the gradient optimization code for...

aromanro

Hi, I was looking over your page here: http://compphysics.github.io/ComputationalPhysics2/doc/pub/vmc/html/vmc-bs.html and I noticed some possible issues. I did not compile and test the programs, though. This line: https://github.com/CompPhysics/ComputationalPhysics2/blob/a840b97b651085090f99bf6a11abab57100c2e85/doc/pub/vmc/programs/c%2B%2B/vmcsolver.cpp#L52 has a multiplication...

aromanro

Bumps [mustache](https://github.com/janl/mustache.js) from 0.7.3 to 3.2.1. Release notes *Sourced from [mustache's releases](https://github.com/janl/mustache.js/releases).* > ## v3.1.0 > ### Added > > * [#717](https://github-redirect.dependabot.com/janl/mustache.js/issues/717): Added support .js files as views in command...

dependabot[bot]

Bumps [express](https://github.com/expressjs/express) from 2.5.11 to 4.17.1. Release notes *Sourced from [express's releases](https://github.com/expressjs/express/releases).* > ## 4.17.1 > * Revert "Improve error message for `null`/`undefined` to `res.status`" > > ## 4.17.0 >...

dependabot[bot]

Exploring the Melting Process of Ice using Quantum Mechanics

1

Dear Professor, I hope this message finds you well. I am a student interested in molecular physics, specifically the melting process of ice. I was wondering if it is possible...

randomwangran