| Les deux révisions précédentes Révision précédente Prochaine révision | Révision précédenteDernière révisionLes deux révisions suivantes |
| teaching:progappchim:matplotlib_gallery:potentiel_energy_surface [2015/05/08 11:32] – villersd | teaching:progappchim:matplotlib_gallery:potentiel_energy_surface [2016/12/14 11:57] – [Références] villersd |
|---|
| * [[http://scitation.aip.org/content/aip/journal/jcp/23/3/10.1063/1.1742043|On a New Method of Drawing the Potential Energy Surface]], Shin Sato, J. Chem. Phys. 23, 592 (1955) | * [[http://scitation.aip.org/content/aip/journal/jcp/23/3/10.1063/1.1742043|On a New Method of Drawing the Potential Energy Surface]], Shin Sato, J. Chem. Phys. 23, 592 (1955) |
| * [[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 |
| | * [[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 |
| |
| |
| | |
| | Voir aussi : |
| | * [[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://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 |
| |
| |