Quantum Systems in Physics, Chemistry and Biology, Theory, Interpretation, and Results, Volume 78, the latest release in the Advances in Quantum Chemistry series 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 biology. It features detailed reviews written by leading international researchers.
Quantum Systems in Physics, Chemistry and Biology, Theory, Interpretation, and Results, Volume 78, the latest release in the Advances in Quantum Chemistry series 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 biology. It features detailed reviews written by leading international researchers.
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Autorenporträt
Samantha Jenkins is at Hunan Normal University, Peoples Republic of China
Inhaltsangabe
1. Molecular Foundation of Evolution Erkki J. Brändas 2. Entanglement Properties of Bound and Resonant Few-Body States Arkadiusz Kuros and Anna Okopinska 3. How Does Vibrational Excitation Affect the X-ray Absorption Spectra of Monohydrated Halide and Alkali Metal Clusters? Kaito Takahashi 4. Complexes of Hyperguinones A and B with a Cu2+ Ion: A DFT Study Liliana Mammino 5. Thermodynamics of 5-Bromouracil Tautomerisation From First-Principles Molecular Dynamics Simulations Leo F. Holroyd, Michael Bühl, Marie-Pierre Gaigeot, and Tanja van Mourik 6. Parallel Cascade Selection Molecular Dynamics Simulations for Transition Pathway Sampling of Biomolecules Ryuhei Harada and Yasuteru Shigeta 7. Non-linear Chaotic Dynamics of Quantum Systems: Molecules in an Electromagnetic Field Anna V. Ignatenko, Anna A. Buyadzhi, Vasily V. Buyadzhi, Anna A. Kuznetsova, Alexander A. Mashkantsev, and Eugeny V. Ternovsky 8. Advanced Quantum Approach in Radiative and Collisional Spectroscopy of Multicharged Ions in Plasmas Vasily V. Buyadzhi, Anna A. Kuznetsova, Anna A. Buyadzhi, Eugeny V. Ternovsky, and Tatyana B. Tkach 9. Quantum Chemistry and Spectroscopy of Pionic Atomic Systems with Accounting for Relativistic, Radiative and Strong Interaction Effects Yuliya V. Dubrovskaya, Olga Yu. Khetselius, Larisa A. Vitavetskaya, Valentin B. Ternovsky and Inga N. Serga 10. Optimized Relativistic Many-Body Perturbation Theory Calculation of Wavelengths and Oscillator Strengths for Li-like Multicharged Ions Olga Yu. Khetselius 11. Multiphoton Spectroscopy of Atoms and Nuclei in a Laser Field: Relativistic Energy Approach and Radiation Atomic Lines Moments Method Alexander V. Glushkov 12. Spectroscopy of Multielectron Atomic Systems in a DC Electric Field Anna A. Kuznetsova, Alexander V. Glushkov, Anna V. Ignatenko, Andrey A. Svinarenko, and Valentin B. Ternovsky 13. Theoretical Elucidation of Geometrical Structures of the CaMn4O5 Cluster in Oxygen Evolving Complex of Photosystem II Scope and Applicability of Estimation Formulae of Structural Deformations via the Mixed-Valence and Jahn-Teller Effects Mitsuo Shoji, Hiroshi Isobe , Shusuke Yamanaka, Yasufumi Umena, Keisuke Kawakami, Nobuo Kamiya, and Kizashi Yamaguchi
1. Molecular Foundation of Evolution Erkki J. Brändas 2. Entanglement Properties of Bound and Resonant Few-Body States Arkadiusz Kuros and Anna Okopinska 3. How Does Vibrational Excitation Affect the X-ray Absorption Spectra of Monohydrated Halide and Alkali Metal Clusters? Kaito Takahashi 4. Complexes of Hyperguinones A and B with a Cu2+ Ion: A DFT Study Liliana Mammino 5. Thermodynamics of 5-Bromouracil Tautomerisation From First-Principles Molecular Dynamics Simulations Leo F. Holroyd, Michael Bühl, Marie-Pierre Gaigeot, and Tanja van Mourik 6. Parallel Cascade Selection Molecular Dynamics Simulations for Transition Pathway Sampling of Biomolecules Ryuhei Harada and Yasuteru Shigeta 7. Non-linear Chaotic Dynamics of Quantum Systems: Molecules in an Electromagnetic Field Anna V. Ignatenko, Anna A. Buyadzhi, Vasily V. Buyadzhi, Anna A. Kuznetsova, Alexander A. Mashkantsev, and Eugeny V. Ternovsky 8. Advanced Quantum Approach in Radiative and Collisional Spectroscopy of Multicharged Ions in Plasmas Vasily V. Buyadzhi, Anna A. Kuznetsova, Anna A. Buyadzhi, Eugeny V. Ternovsky, and Tatyana B. Tkach 9. Quantum Chemistry and Spectroscopy of Pionic Atomic Systems with Accounting for Relativistic, Radiative and Strong Interaction Effects Yuliya V. Dubrovskaya, Olga Yu. Khetselius, Larisa A. Vitavetskaya, Valentin B. Ternovsky and Inga N. Serga 10. Optimized Relativistic Many-Body Perturbation Theory Calculation of Wavelengths and Oscillator Strengths for Li-like Multicharged Ions Olga Yu. Khetselius 11. Multiphoton Spectroscopy of Atoms and Nuclei in a Laser Field: Relativistic Energy Approach and Radiation Atomic Lines Moments Method Alexander V. Glushkov 12. Spectroscopy of Multielectron Atomic Systems in a DC Electric Field Anna A. Kuznetsova, Alexander V. Glushkov, Anna V. Ignatenko, Andrey A. Svinarenko, and Valentin B. Ternovsky 13. Theoretical Elucidation of Geometrical Structures of the CaMn4O5 Cluster in Oxygen Evolving Complex of Photosystem II Scope and Applicability of Estimation Formulae of Structural Deformations via the Mixed-Valence and Jahn-Teller Effects Mitsuo Shoji, Hiroshi Isobe , Shusuke Yamanaka, Yasufumi Umena, Keisuke Kawakami, Nobuo Kamiya, and Kizashi Yamaguchi
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