Bibliography

BCE+21

Christoph Bannwarth, Eike Caldeweyher, Sebastian Ehlert, Andreas Hansen, Philipp Pracht, Jakob Seibert, Sebastian Spicher, and Stefan Grimme. Extended tight‐binding quantum chemistry methods. Wiley Interdiscip. Rev. Comput. Mol. Sci., March 2021. URL: https://onlinelibrary.wiley.com/doi/10.1002/wcms.1493, doi:10.1002/wcms.1493.

HJorgensenO00

Trygve Helgaker, Poul Jørgensen, and Jeppe Olsen. Molecular Electronic-Structure Theory. Wiley, 1 edition edition, October 2000. ISBN 9780471967552. URL: https://play.google.com/store/books/details?id=2G8vAQAAIAAJ.

KN14

Joanna Kauczor and Patrick Norman. Efficient Calculations of Molecular Linear Response Properties for Spectral Regions. J. Chem. Theory Comput., 10(6):2449–2455, June 2014. URL: http://dx.doi.org/10.1021/ct500114m, doi:10.1021/ct500114m.

LPL+17

Xin Li, Robert M Parrish, Fang Liu, Sara I L Kokkila Schumacher, and Todd J Martínez. An Ab Initio Exciton Model Including Charge-Transfer Excited States. J. Chem. Theory Comput., 13(8):3493–3504, August 2017. URL: http://dx.doi.org/10.1021/acs.jctc.7b00171, doi:10.1021/acs.jctc.7b00171.

SO96

Attila Szabo and Neil S Ostlund. Modern Quantum Chemistry: Introduction to Advanced Electronic Structure Theory. Dover Books on Chemistry. Courier Corporation, July 1996. ISBN 9780486691862. URL: https://play.google.com/store/books/details?id=k-DcCgAAQBAJ.

WS16

Lee-Ping Wang and Chenchen Song. Geometry optimization made simple with translation and rotation coordinates. J. Chem. Phys., 144(21):214108, June 2016. URL: http://dx.doi.org/10.1063/1.4952956, doi:10.1063/1.4952956.