26 citations · 26 across the 1 of their papers we have counts for
2 papers
physics.chem-ph2022★ 26 cited
The MRChem multiresolution analysis code for molecular electronic structure calculations: performance and scaling properties
Peter Wind, Magnar Bjørgve, Anders Brakestad +4
MRChem is a code for molecular electronic structure calculations, based on a multiwavelet adaptive basis representation. We provide a description of our implementation strategy and…
physics.chem-ph2017
Dynamical Insights into the Decomposition of 1,2-Dioxetane
Morgane Vacher, Anders Brakestad, Hans O. Karlsson +2
Chemiluminescence in 1,2-dioxetane occurs through a thermally activated decomposition reaction into two formaldehyde molecules. Both ground-state and nonadiabatic dynamics (includi…