Bastien Mussard
University of Colorado Boulder(US)
Publications by Year
Research Areas
Advanced Chemical Physics Studies, Spectroscopy and Quantum Chemical Studies, Quantum, superfluid, helium dynamics, High-pressure geophysics and materials, Machine Learning in Materials Science
Most-Cited Works
- → Recent developments in the PySCF program package(2020)1,065 cited
- → Electrostatic Potential Derived Atomic Charges for Periodic Systems Using a Modified Error Functional(2009)348 cited
- → Cheap and Near Exact CASSCF with Large Active Spaces(2017)210 cited
- → One-Step Treatment of Spin–Orbit Coupling and Electron Correlation in Large Active Spaces(2017)60 cited
- → Basis convergence of range-separated density-functional theory(2015)46 cited
- → Dielectric Matrix Formulation of Correlation Energies in the Random Phase Approximation: Inclusion of Exchange Effects(2016)34 cited
- → Short range DFT combined with long-range local RPA within a range-separated hybrid DFT framework(2012)32 cited
- → Self-Consistent Range-Separated Density-Functional Theory with Second-Order Perturbative Correction via the Optimized-Effective-Potential Method(2019)23 cited
- → Erratum: “Spin-unrestricted random-phase approximation with range separation: Benchmark on atomization energies and reaction barrier heights” [J. Chem. Phys. 142, 154123 (2015)](2015)9 cited
- → Relationships between charge density response functions, exchange holes and localized orbitals(2014)8 cited