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teaching:progappchim:matplotlib_gallery:potentiel_energy_surface [2016/04/29 04:29]
villersd
teaching:progappchim:matplotlib_gallery:potentiel_energy_surface [2016/12/14 11:57] (Version actuelle)
villersd [Références]
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   * [[http://​www.tc.chemie.uni-siegen.de/​jaquet/​Copy-of-introPEStexpowerlight.pdf|Introduction to potential energy surfaces and graphical interpretation]],​ Ralph Jaquet (2002)   * [[http://​www.tc.chemie.uni-siegen.de/​jaquet/​Copy-of-introPEStexpowerlight.pdf|Introduction to potential energy surfaces and graphical interpretation]],​ Ralph Jaquet (2002)
   * [[http://​onlinelibrary.wiley.com/​doi/​10.1002/​bbpc.192900025/​abstract|QUANTENMECHANISCHE DEUTUNG DES VORGANGS DER AKTIVIERUNG]] F. London Zeitschrift für Elektrochemie und angewandte physikalische Chemie. Volume 35, Issue 9, pages 552–555, September 1929   * [[http://​onlinelibrary.wiley.com/​doi/​10.1002/​bbpc.192900025/​abstract|QUANTENMECHANISCHE DEUTUNG DES VORGANGS DER AKTIVIERUNG]] F. London Zeitschrift für Elektrochemie und angewandte physikalische Chemie. Volume 35, Issue 9, pages 552–555, September 1929
 +  * [[https://​www.youtube.com/​playlist?​list=PLkNVwyLvX_TFBLHCvApmvafqqQUHb6JwF|Computational Chemistry Universitu Minesota]], vidéos,...
 +  * W H Miller, Recent Advances in Quantum Mechanical Reactive Scattering Theory, Including Comparison of Recent Experiments with Rigorous Calculations of State-to-State Cross Sections for the H/​D+H2→H2/​HD+H Reactions, Annual Review of Physical Chemistry, Vol. 41: 245-281 (Volume publication date October 1990) DOI: 10.1146/​annurev.pc.41.100190.001333
 +  * Peterson, Kirk A., Woon, David E., Dunning, Thom H. , Benchmark calculations with correlated molecular wave functions. IV. The classical barrier height of the H+H2→H2+H reaction, ​ Journal of Chemical Physics. 5/15/1994, Vol. 100 Issue 10, p7410
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 Voir aussi : Voir aussi :
   * [[http://​chemistry.stackexchange.com/​questions/​47665/​ballistic-behavior-of-molecules-on-potential-energy-surfaces]]   * [[http://​chemistry.stackexchange.com/​questions/​47665/​ballistic-behavior-of-molecules-on-potential-energy-surfaces]]
   * [[http://​chemistry.stackexchange.com/​questions/​50253/​compute-minimum-energy-paths-from-arbitrary-positions-on-the-potential-energy-su]]   * [[http://​chemistry.stackexchange.com/​questions/​50253/​compute-minimum-energy-paths-from-arbitrary-positions-on-the-potential-energy-su]]
 +  * [[http://​pubs.acs.org/​doi/​full/​10.1021/​acs.jchemed.6b00572|Let Students Derive, by Themselves, Two-Dimensional Atomic and Molecular Quantum Chemistry from Scratch]], Yingbin Ge, J. Chem. Educ., 2016, 93 (12), pp 2033–2039 DOI: 10.1021/​acs.jchemed.6b00572
  
  
teaching/progappchim/matplotlib_gallery/potentiel_energy_surface.1461896989.txt.gz · Dernière modification: 2016/04/29 04:29 par villersd