David Casanova
5PUBLICATIONS
132CO-AUTHORS
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Publications (5)
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|Sep 02, 2021
Software for the frontiers of quantum chemistry: An overview of developments in the Q-Chem 5 package.Evgeny Epifanovsky, Andrew T B Gilbert, Xintian Feng
|Apr 03, 2021
Short-range DFT energy correction to multiconfigurational wave functions for open-shell systems.José Aarón Rodríguez-Jiménez, Abel Carreras, David Casanova
|Dec 09, 2020
Calculation of spin-orbit couplings using RASCI spinless one-particle density matrices: Theory and applications.Abel Carreras, Hanjie Jiang, Pavel Pokhilko
|Jun 03, 2019
Singlet fission in spiroconjugated dimers.María E Sandoval-Salinas, Abel Carreras, Juan Casado
|Apr 02, 2018
Short-range density functional correlation within the restricted active space CI method.David Casanova
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Frequent Collaborators
3 joint publications
Abel Carreras
2 joint publications
Hanjie Jiang
2 joint publications
Anna I Krylov
2 joint publications
Paul M Zimmerman
1 joint publications
María E Sandoval-Salinas
1 joint publications
Juan Casado
1 joint publications
Pavel Pokhilko
1 joint publications
José Aarón Rodríguez-Jiménez
1 joint publications
Xintian Feng
1 joint publications
Yuezhi Mao
