Search Result "time-dependent Hartree-Fock"
Multinucleon transfer reaction in time-dependent Hartree-Fock theory
Ebook: Frontiers in Nuclear and Particle Physics
Volume: 2 Year: 2019
Author(s): Kazuyuki Sekizawa,Kazuhiro Yabana
Doi: 10.2174/9781681087641119020007
Quantum Mechanical (QM) Calculations Applied to ADMET Drug Prediction: A Review
Journal: Current Drug Metabolism
Volume: 18 Issue: 6 Year: 2017 Page: 511-526
Author(s): E. F. Silva-Júnior,T. M. Aquino,J. X. Araújo-Júnior
Density constrained TDHF
Ebook: Frontiers in Nuclear and Particle Physics
Volume: 2 Year: 2019
Author(s): V.E. Oberacker,A.S. Umar
Doi: 10.2174/9781681087641119020006
Synthesis and Reactions of β-Oxophosphoranes / Ylides Containing a Cyclic or Acyclic P-Moiety
Journal: Current Organic Chemistry
Volume: 8 Issue: 1 Year: 2004 Page: 1245-1261
Author(s): Gyorgy Keglevich, Henrietta Forintos, Tamas Kortvelyesi
Counting particles in microscopic systems
Ebook: Frontiers in Nuclear and Particle Physics
Volume: 2 Year: 2019
Author(s): Cédric Simenel
Doi: 10.2174/9781681087641119020009
Numerical Calculations of TDHF
Ebook: Frontiers in Nuclear and Particle Physics
Volume: 2 Year: 2019
Author(s): P. D. Stevenson
Doi: 10.2174/9781681087641119020005
The Essence of Density Functional Theory
Ebook: DFT Based Studies on Bioactive Molecules
Volume: 1 Year: 2021
Author(s): Ambrish Kumar Srivastava,Neeraj Misra
Doi: 10.2174/9789814998369121010003
Organic Dyes Containing A Triple Bond Spacer for Dye Sensitized Solar Cells: A Combined Experimental and Theoretical Investigation
Journal: Current Organic Chemistry
Volume: 15 Issue: 1 Year: 2011 Page: 3535-3543
Author(s): Angela Scrascia, Mariachiara Pastore, Lunxiang Yin, Rosaria Anna Picca, Michele Manca, Ying-Cen Guo, Filippo De Angelis, Fabio Della Sala, Roberto Cingolani, Giuseppe Gigli, Giuseppe Ciccarella
The Fundamentals of Molecular Simulations
Ebook: A Journey Through Water: A Scientific Exploration of The Most Anomalous Liquid on Earth
Volume: 1 Year: 2017
Author(s): Jestin Baby Mandumpal
Doi: 10.2174/9781681084237117010006
Quantum Chemical Approaches: Semiempirical Molecular Orbital and Hybrid Quantum Mechanical/Molecular Mechanical Techniques
Journal: Current Pharmaceutical Design
Volume: 20 Issue: 20 Year: 2014 Page: 3293-3302
Author(s): Richard A. Bryce,Ian H. Hillier