output
20172025
most citedQuantum Package 2.0: An Open-Source Determinant-Driven Suite of Programs

171 citations

researchers with a paper here

Counting papers with at most 25 authors, so collaboration author lists do not stand in for the people here.

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Showing 2025Show all

3 papers · 1 filter

physics.comp-ph2025★ 10 cited

A Descriptor Is All You Need: Accurate Machine Learning of Nonadiabatic Coupling Vectors

Jakub Martinka, Lina Zhang, Yi-Fan Hou +4

Nonadiabatic couplings (NACs) play a crucial role in modeling photochemical and photophysical processes with methods such as the widely used fewest-switches surface hopping (FSSH).…

quant-ph2025★ 4 cited

The Quantum Measurement Problem: A Review of Recent Trends

Anderson A. Tomaz, Rafael S. Mattos, Mario Barbatti

Left on its own, a quantum state evolves deterministically under the Schrödinger Equation, forming superpositions. Upon measurement, however, a stochastic process governed by the B…

physics.chem-ph2025★ 39 cited

Roadmap for Molecular Benchmarks in Nonadiabatic Dynamics

Léon E. Cigrang, Basile F. E. Curchod, Rebecca A. Ingle +42

Simulating the coupled electronic and nuclear response of a molecule to light excitation requires the application of nonadiabatic molecular dynamics. However, when faced with a spe…