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A quantum computing view on unitary coupled cluster theory2022 Chemical Society Reviews review Computer Science Quantum Computing Algorithms and Architecture Open access cited by 2 patents
Abhinav Anand, Philipp Schleich, Sumner Alperin-Lea, Phillip W. K. Jensen, Sukin Sim, Manuel Díaz‐Tinoco, +4 more
218citations -
The DIRAC code for relativistic molecular calculations2020 LillOA (Université de Lille (University Of Lille)) article Physics and Astronomy Advanced Chemical Physics Studies Open access
Trond Saue, Radovan Bast, André Severo Pereira Gomes, Hans Jørgen Aa. Jensen, Lucas Visscher, I. Agustín Aucar, +20 more
83citations -
Non-Covalent Forces in Naphthazarin—Cooperativity or Competition in the Light of Theoretical Approaches2021 International Journal of Molecular Sciences article Chemistry Crystallography and molecular interactions Open access
Aneta Jezierska, Kacper Błaziak, Sebastian Klahm, Arne Lüchow, Jarosław Jan Panek
9citations -
Valence and Rydberg excited state bond dissociation curves of CO2 from orbital-optimized density functional calculations2026 arXiv (Cornell University) preprint Physics and Astronomy Advanced Chemical Physics Studies Open access
Darío Barreiro‐Lage, Gianluca Levi, Hannes Jónsson, Thanja Lamberts
0citations -
Interaction of Aromatic Molecules with Forsterite: Accuracy of the Periodic DFT-D4 Method2021 The Journal of Physical Chemistry A article Physics and Astronomy Advanced Chemical Physics Studies Open access
Dario Campisi, Thanja Lamberts, Nelson Yaw Dzade, Rocco Martinazzo, I. L. ten Kate, Alexander G. G. M. Tielens
13citations
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