Browse Code
JDFTx is a plane-wave density functional theory code designed for electronic structure theory development. One prominent unique capability is the treatment of solvated electronic systems using joint density functional theory. Please see http://jdftx.org for download and compile instructions, tutorials, documentation and citation information.
Features
- Electronic DFT
- Classical DFT
- Solvation models
- Wannier functions
- Electron-phonon interactions
- Hybrid MPI/pthreads parallelization
- CUDA support for GPU acceleration
License
GNU General Public License version 3.0 (GPLv3)Follow JDFTx
Other Useful Business Software
Passwordless Authentication and Passwordless Security
It’s no secret — passwords can be a real headache, both for the people who use them and the people who manage them. Over time, we’ve created hundreds of passwords, it’s easy to lose track of them and they’re easily compromised. Fortunately, passwordless authentication is becoming a feasible reality for many businesses. Duo can help you get there.
Rate This Project
Login To Rate This Project
User Reviews
Be the first to post a review of JDFTx!