Skip to content

stanpapa/ferric

Repository files navigation

This is a quantum chemistry program written in Rust for fun and educational purposes

Features:

  • RHF energies
  • UHF energies

How to build:

`cargo build`

This will first build the library, followed by the binaries. If you want to run the program you could call

`cargo run input.yaml`

which will compile the program (if neccesary) and run Ferric

About

No description, website, or topics provided.

Resources

License

Stars

Watchers

Forks

Releases

No releases published

Packages

 
 
 

Contributors