Advances in Quantum Systems in Chemistry, Physics, and Biology: Selected Proceedings of QSCP-XXIII (Kruger Park, South Africa, September 2018)
 
A termék adatai:

ISBN13:9783030349400
ISBN10:3030349403
Kötéstípus:Keménykötés
Terjedelem:469 oldal
Méret:235x155 mm
Súly:893 g
Nyelv:angol
Illusztrációk: XVI, 469 p. Illustrations, black & white
177
Témakör:

Advances in Quantum Systems in Chemistry, Physics, and Biology

Selected Proceedings of QSCP-XXIII (Kruger Park, South Africa, September 2018)
 
Kiadás sorszáma: 1st ed. 2020
Kiadó: Springer
Megjelenés dátuma:
Kötetek száma: 1 pieces, Book
 
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  példányt

 
Rövid leírás:

This edited, multi-author book gathers selected, peer-reviewed contributions based on papers presented at the 23rd International Workshop on Quantum Systems in Chemistry, Physics, and Biology (QSCP-XXIII), held in Mopani Camp, The Kruger National Park, South Africa, in September 2018. The content is primarily intended for scholars, researchers, and graduate students working at universities and scientific institutes who are interested in the structure, properties, dynamics, and spectroscopy of atoms, molecules, biological systems, and condensed matter.


Hosszú leírás:

This edited, multi-author book gathers selected, peer-reviewed contributions based on papers presented at the 23rd International Workshop on Quantum Systems in Chemistry, Physics, and Biology (QSCP-XXIII), held in Mopani Camp, The Kruger National Park, South Africa, in September 2018. The content is primarily intended for scholars, researchers, and graduate students working at universities and scientific institutes who are interested in the structure, properties, dynamics, and spectroscopy of atoms, molecules, biological systems, and condensed matter.


Tartalomjegyzék:

Part I. Exotic Atomic Systems                                                                            



 



Advanced Relativistic Energy Approach in the Spectroscopy of



Auto-ionization States of Multi-electron Atomic Systems



Alexander V. Glushkov                                                                                       



 



Relativistic Quantum Chemistry and Spectroscopy of Kaonic



Atomic Systems with Accounting for Radiative and Strong Interaction Effects



O. Yu. Khetselius, V. B. Ternovsky, Y.V. Dubrovskaya, I.N. Serga,



and A. A. Svinarenko                                                                                                           



 



Spectroscopy of Rydberg Atomic Systems in a Black-Body Radiation Field



Valentin B. Ternovsky, Alexander V. Glushkov, Anna A. Kuznetsova, and Andrey V. Tsudik                                                                                                



 



Hyperfine and Electroweak Interactions in Heavy Finite Fermi Systems and Parity Non-conservation Effect



Olga Yu. Khetselius, Alexander V. Glushkov, Eugeny Ternovsky,



Vasily V. Buyadzhi, and Aleksii L. Mykhailov                                              



 



Part II. Clusters and Molecules Interactions                                               



 



Quantum Study of Helium Clusters Doped with Electronically Excited Li, Na, K and Rb Atoms



David Dell?Angelo                                                                                                                



 



A Quantum Chemical Approach for the Characterization of the Interaction Potential of Propylene Oxide with Rare-Gas Atoms



(He, Ne, Ar)



Partricia R. P. Barreto, Ana Claudia P. S. Cruz, Henrique O. Euclides, Alessandra F. Albernaz, Federico Palazzetti, and Fernando Pirani                     



 



A Theoretical Study on the Reaction between Chloroacetic Acid and Thiourea



Mwadham M. Kabanda and Kgalaletso P. Otukile                                                    



 



Density Functional Theory Studies of Ruthenium (N3) Dye Adsorbed on a TiO2 Brookite Nanocluster for Application to Dye Sensitized Solar Cells



I. F. Elegbeleye, N. E. Maluta, and R. R. Maphanga                                                  



 



Part III. Biochemistry and Biophysics                                                



 



Complexes of Furonewguinone-B with a Cu2+ Ion. A DFT Study



Liliana Mammino                                                                                                                    



 



Computational Study of Shuangancistrotectorine-A: A Naphthyliso-quinoline Alkaloid with Antimalarial Activity



Mireille Bilonda and Liliana Mammino                                                           



 



Ab initio and DFT Computational Study of Myristinin-A and a Structurally Related Molecule



Neani Tshilande and Liliana Mammino                                                          



 



Current Problems in Computer Simulation of Variability of the



Three-Dimensional Structure of DNA



V. Poltev, V.M. Anisimov1, V. Dominguez, A. Deriabina, E. Gonzalez,



D. Garcia, V. Vázquez-Báez, F. Rivas                                                                              



 



Part IV. Fundamental Theory                                                               



 



Efficient ?Middle? Thermostat Scheme for the Quantum / Classical Canonical Ensemble via Molecular Dynamics



Xinzijian Liu, Kangyu Yan, and Jian Liu                                                           



 



Megascopic Quantum Phenomena: A Critical Study of Physical Interpretations



Michal Crvek                                                                                                                          



 



Is Abiogenesis Supported by the Second Law of Thermodynamics?



Erkki J. Brändas                                                                                                                      



 



Can Quantum Theory Concepts Shed Light on Biological Evolution Processes? Jean Maruani