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20212024
most citedAb-Initio Molecular Dynamics with Screened Lorentz Forces. Part I. Calculation and Atomic Charge Interpretation of Berry Curvature

37 citations · 125 across the 9 of their papers we have counts for

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physics.chem-ph2024

Non-adiabatic coupling matrix elements in a magnetic field: geometric gauge dependence and Berry phase

Tanner Culpitt, Erik I. Tellgren, Laurens D. M. Peters +1

Non-adiabatic coupling matrix elements (NACMEs) are important in quantum chemistry, particularly for molecular dynamics methods such as surface hopping. However, NACMEs are gauge d…