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- potentiel_energy_surface
- notions de [[http://en.wikipedia.org/wiki/Activated_complex|complexe activé]] (activated complex) ou [[http://en.wikipedia.org/wiki/Transition_state|état... ng, Thom H. , Benchmark calculations with correlated molecular wave functions. IV. The classical barri... * [[http://pubs.acs.org/doi/full/10.1021/acs.jchemed.6b00572|Let Students Derive, by Themselves, Two-D
- pka_pkb_plane
- subplot(1, 1, 1) plt.plot(pKasa, pKbsa, color="red", linewidth=2.0, linestyle="-", label="Acides for... rad=.2")) plt.scatter([-3, ],[17, ], 50, color='red') plt.annotate('HCl ⇌ Cl⁻ (pKa = -3)',
- potentiel_morse
- els]] Philip M. Morse, Phys. Rev. 34, 57 – Published 1 July 1929. DOI : [[http://dx.doi.org/10.1103/Ph
- ir_spectrum_co
- "" import csv # module nécessaire "comma separated values" import numpy as np import matplotlib.pypl... [http://docs.scipy.org/doc/numpy/reference/generated/numpy.convolve.html|numpy.convolve]] (+ [[http://