Lori A. Burns
0000-0003-2852-5864
6 papers found
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Benchmark coupled-cluster lattice energy of crystalline benzene and assessment of multi-level approximations in the many-body expansion
Psi4 1.4: Open-source software for high-throughput quantum chemistry
Python implementation of the restrained electrostatic potential charge model
Psi4NumPy: An Interactive Quantum Chemistry Programming Environment for Reference Implementations and Rapid Development
The BioFragment Database (BFDb): An open-data platform for computational chemistry analysis of noncovalent interactions
Psi4 1.1: An Open-Source Electronic Structure Program Emphasizing Automation, Advanced Libraries, and Interoperability
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