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A unified Monte Carlo treatment of the transport of electromagnetic energy, electrons, and phonons in absorbing and scattering media

✍ Scribed by Basil T. Wong; M. Pinar Mengüç

Publisher
Elsevier Science
Year
2010
Tongue
English
Weight
922 KB
Volume
111
Category
Article
ISSN
0022-4073

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A Monte Carlo simulation of free energy relationships for the electron transfer reaction between Fe+ and Fe2+ in water
✍ Angels González-Lafont; José M. Lluch; Antonio Oliva; Juan Bertrán 📂 Article 📅 1991 🏛 John Wiley and Sons 🌐 English ⚖ 555 KB

A free energy barrier AF+ = 174.2 kJ/mol for the self-exchange electron transfer reaction model Fe+/Fe2+ in water has been calculated by combining Monte Carlo simulations and the statistical perturbation theory. We have shown that, even for those electron transfer reactions that present a very high