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Journal of Chemical Theory and Computation|August 13, 2024
Coupled Cluster Theory for Nonadiabatic Dynamics: Nuclear Gradients and Nonadiabatic Couplings in Similarity Constrained Coupled Cluster TheoryEirik F Kjønstad, Sara Angelico, Henrik KochThe Journal of Physical Chemistry Letters|January 8, 2025
Determining Minimum Energy Conical Intersections by Enveloping the Seam: Exploring Ground and Excited State Intersections in Coupled Cluster TheorySara Angelico, Eirik F Kjønstad, Henrik KochThe Journal of Chemical Physics|December 5, 2023
Coupled cluster cavity Born-Oppenheimer approximation for electronic strong couplingSara Angelico, Tor S Haugland, Enrico Ronca, et al.Journal of Chemical Theory and Computation|October 15, 2025
Similarity Constrained CC2: Toward Efficient Coupled Cluster Nonadiabatic Dynamics among Excited StatesLeo Stoll, Sara Angelico, Eirik F Kjønstad, et al.The Journal of Physical Chemistry Letters|January 8, 2025
Generalized Coupled Cluster Theory for Ground and Excited State IntersectionsFederico Rossi, Eirik F Kjønstad, Sara Angelico, et al.The Journal of Chemical Physics|May 4, 2021
A polarizable three-layer frozen density embedding/molecular mechanics approachFranco Egidi, Sara Angelico, Piero Lafiosca, et al.Journal of Chemical Theory and Computation|October 11, 2024
Analytical Evaluation of Ground State Gradients in Quantum Electrodynamics Coupled Cluster TheoryMarcus T Lexander, Sara Angelico, Eirik F Kjønstad, et al.Nature Communications|November 23, 2024
Photoinduced hydrogen dissociation in thymine predicted by coupled cluster theoryEirik F Kjønstad, O Jonathan Fajen, Alexander C Paul, et al.The Journal of Chemical Physics|April 6, 2026
e T 2.0: An efficient open-source molecular electronic structure programSarai Dery Folkestad, Eirik F Kjønstad, Alexander C Paul, et al.Pageof 1