11. Effective fragment potential method in Q‐CHEM: A guide for users and developers. Issue 12 (15th January 2013) Authors: Ghosh, Debashree; Kosenkov, Dmytro; Vanovschi, Vitalii; Flick, Joanna; Kaliman, Ilya; Shao, Yihan; Gilbert, Andrew T.B.; Krylov, Anna I.; Slipchenko, Lyudmila V. Journal: Journal of computational chemistry Issue: Volume 34:Issue 12(2013) Page Start: 1060 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
12. EOM-CC guide to Fock-space travel: the C2 edition. (15th May 2019) Authors: Gulania, Sahil; Jagau, Thomas-C.; Krylov, Anna I. Journal: Faraday discussions Issue: Volume 217(2019) Page Start: 514 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
13. Frontiers in Multiscale Modeling of Photoreceptor Proteins. (13th February 2021) Authors: Mroginski, Maria‐Andrea; Adam, Suliman; Amoyal, Gil S.; Barnoy, Avishai; Bondar, Ana‐Nicoleta; Borin, Veniamin A.; Church, Jonathan R.; Domratcheva, Tatiana; Ensing, Bernd; Fanelli, Francesca; Ferré, Nicolas; Filiba, Ofer; Pedraza‐González, Laura; González, Ronald; González‐Espinoza, Cristina E.;... Journal: Photochemistry and photobiology Issue: Volume 97:Number 2(2021) Page Start: 243 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
14. How to stay out of trouble in RIXS calculations within equation-of-motion coupled-cluster damped response theory? Safe hitchhiking in the excitation manifold by means of core–valence separation. Issue 5 (10th October 2019) Authors: Nanda, Kaushik D.; Vidal, Marta L.; Faber, Rasmus; Coriani, Sonia; Krylov, Anna I. Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 5(2020) Page Start: 2629 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
15. In search of molecular ions for optical cycling: a difficult road. Issue 30 (23rd July 2020) Authors: Ivanov, Maxim V.; Jagau, Thomas-C.; Zhu, Guo-Zhu; Hudson, Eric R.; Krylov, Anna I. Journal: Physical chemistry chemical physics Issue: Volume 22:Issue 30(2020) Page Start: 17075 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
16. Libwfa: Wavefunction analysis tools for excited and open‐shell electronic states. (12th January 2022) Authors: Plasser, Felix; Krylov, Anna I.; Dreuw, Andreas Journal: Wiley interdisciplinary reviews Issue: Volume 12:Number 4(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
17. Ligand influence on the electronic spectra of monocationic copper–bipyridine complexes. Issue 47 (16th November 2015) Authors: Xu, Shuang; Gozem, Samer; Krylov, Anna I.; Christopher, Casey R.; Mathias Weber, J. Journal: Physical chemistry chemical physics Issue: Volume 17:Issue 47(2015) Page Start: 31938 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
18. Magnetic exchange interactions in binuclear and tetranuclear iron(III) complexes described by spin‐flip DFT and Heisenberg effective Hamiltonians. Issue 3 (14th June 2022) Authors: Kotaru, Saikiran; Kähler, Sven; Alessio, Maristella; Krylov, Anna I. Journal: Journal of computational chemistry Issue: Volume 44:Issue 3(2023) Page Start: 367 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
19. New algorithm for tensor contractions on multi‐core CPUs, GPUs, and accelerators enables CCSD and EOM‐CCSD calculations with over 1000 basis functions on a single compute node. Issue 11 (1st March 2017) Authors: Kaliman, Ilya A.; Krylov, Anna I. Journal: Journal of computational chemistry Issue: Volume 38:Issue 11(2017) Page Start: 842 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
20. New algorithms for iterative matrix‐free eigensolvers in quantum chemistry. Issue 5 (2nd December 2014) Authors: Zuev, Dmitry; Vecharynski, Eugene; Yang, Chao; Orms, Natalie; Krylov, Anna I. Journal: Journal of computational chemistry Issue: Volume 36:Issue 5(2015) Page Start: 273 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗