Chemical Physics and Quantum Chemistry

Advances in Quantum Chemistry presents surveys of current topics in this rapidly developing field one that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry, and biology. It features detailed reviews written by leading international researchers. In this volume the readers are presented with an exciting combination of themes.

Presents surveys of current topics in this rapidly-developing field that has emerged at the cross section of the historically established areas of mathematics, physics, chemistry and biologyFeatures detailed reviews written by leading international researchersTopics include: New advances in Quantum Chemical Physics; Original theory and a contemporary overview of the field of Theoretical Chemical Physics; State-of-the-Art calculations in Theoretical Chemistry

1. János Ladik some reminiscences

Maximilian Seel

The tragicomedy of modern theoretical biology

Maximilian Seel and János Ladik

2. Molecular attochemistry: Correlated electron dynamics driven by light

Peter Saalfrank, Florian Bedurke, Chiara Heide, Tillmann Klamroth, Stefan Klinkusch, Pascal Krause, Mathias Nest and Jean Christophe Tremblay

3. Fundamental and approximate symmetries, parity violation and tunneling in chiral and achiral molecules

Martin Quack, Georg Seyfang and Gunther Wichmann

4. On the development and implementation of multi-CPU parallel versions of accurate, general purpose, methods of multireference perturbation theories

Run R. Li and Mark R. Hoffmann

5. Treating the motion of nuclei and electrons in atomic and molecular quantum mechanical calculations on an equal footing: Non-Born–Oppenheimer quantum chemistry

Saeed Nasiri, Sergiy Bubin and Ludwik Adamowicz

6. The bound state stability of the hydride ion in HF theory

Hazel Cox, Adam L. Baskerville, Ville J.J. Syrjanen and Michael Melgaard

7. Theoretical study of bisphenol A photolysis

Elena N. Bocharnikova, Olga N. Tchaikovskaya, Olga K. Bazyl, Viktor Ya. Artyukhov and George V. Mayer

8. The anisotropy and temperature dependence in the mobility of rubrene

Yu-Jie Zhong, Chang-Feng Lan, Bo-Chao Lin, Chong-Der Hu, Yuan-Chung Cheng and Chao-Ping Hsu

9. Competing excited-state deactivation processes in bacteriophytochromes

Bo Durbeej

10. The influence of monovalent and divalent metal cations on the stability of the DNA-protein interaction in the nucleosome core particle

Alex-Adrian Farcaș and Attila Bende

11. Quantum chemistry assisted by machine learning