Don Danilov

3PUBLICATIONS
7CO-AUTHORS
Theoretical quantum chemistryRadiation and matterElectrical energy generation (incl. renewables, excl. photovoltaics)
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Publications (3)

|Jan 16, 2025
Capturing Strong Correlation in Molecules with Phaseless Auxiliary-Field Quantum Monte Carlo Using Generalized Hartree-Fock Trial Wave Functions.

Don Danilov, Brad Ganoe, Mark Munyi

|Jun 26, 2023
Coherent Mixing of Singlet and Triplet States in Acrolein and Ketene: A Computational Strategy for Simulating the Electron-Nuclear Dynamics of Intersystem Crossing.

Don Danilov, Andrew J Jenkins, Michael J Bearpark

|Jul 01, 2022
How electronic superpositions drive nuclear motion following the creation of a localized hole in the glycine radical cation.

Don Danilov, Thierry Tran, Michael J Bearpark

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Frequent Collaborators

2 joint publications

Graham A Worth

2 joint publications

Michael A Robb

1 joint publications

Thierry Tran

1 joint publications

Michael J Bearpark