TeraChem: Accelerating electronic structure and ab initio molecular dynamics with graphical processing units
- Stefan Seritan
- Christoph Bannwarth
- et al.
- 2020
- The Journal of Chemical Physics
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TeraChem: A graphical processing unit-accelerated electronic structure package for large-scale ab initio molecular dynamics
- Stefan Seritan
- Christoph Bannwarth
- et al.
- 2020
- WIREs Computational Molecular Science