✦ LIBER ✦

Dynamics of hydrogen atom and proton transfer reactions. Simplified analytic two-state formulae

✍ Scribed by Vasil K. Babamov; Vicente Lopez; R.A. Marcus

Publisher: Elsevier Science
Year: 1983
Tongue: English
Weight: 499 KB
Volume: 101
Category: Article
ISSN: 0009-2614
DOI: 10.1016/0009-2614(83)87024-9

No coin nor oath required. For personal study only.

✦ Synopsis

Analytical formulae for the threshold region of the reaction probability curve for a nearly degenerate H-atom transfer XC @en and shown to yield good agreement with e.\act results for a t\o-state model system. Application to H and H+ transfer in complcl systems is discussed. * Contribution No. 6884. * Also at California Institute of Technolog.

📜 SIMILAR VOLUMES

Comparison of Hydride, Hydrogen Atom, an

Comparison of Hydride, Hydrogen Atom, and Proton-Coupled Electron Transfer Reactions

✍ Sharon Hammes-Schiffer 📂 Article 📅 2002 🏛 John Wiley and Sons 🌐 English ⚖ 180 KB 👁 2 views

A comparison of hydride, hydrogen atom, and proton-coupled electron transfer reactions is presented. Herein, hydride and hydrogen atom transfer refer to reactions in which the electrons and protons transfer between the same donor and acceptor, while proton-coupled electron transfer (PCET) refers to

A dynamical theory of nonadiabatic proto

A dynamical theory of nonadiabatic proton and hydrogen atom transfer reaction rates in solution

✍ Daniel C. Borgis; Sangyoub Lee; James T. Hynes 📂 Article 📅 1989 🏛 Elsevier Science 🌐 English ⚖ 627 KB

A dynamical theory for the rate constant k of hydrogen atom and proton transfer reactions in solution is presented for the nonadiabatic limit, where reaction is dominated by tunneling. Coupling and splitting fluctuation effects arising from intramolecular vibrational and solvent fluctuations are inc

Bimolecular reactions of distonic ions:

Bimolecular reactions of distonic ions: Proton transfer and hydrogen atom abstraction with ˙CH2OH2+

✍ Philippe Mourgues; Henri Edouard Audier; Danielle Leblanc; Steen Hammerum 📂 Article 📅 1993 🏛 John Wiley and Sons 🌐 English ⚖ 314 KB

The bimolecular reaction of 'CH20H2+ with a variety of neutral molecules in the gas phase were studied by Fourier transform ion cyclotron resonance experiments. The distonic ion is found to be considerably more acidic than protonated methanol; bracketing experiments provide a value of 695 8 kJ mol-'

Proton dynamics in an extended array of

Proton dynamics in an extended array of hydrogen bonds: normal coordinates, proton transfer and macroscopic quantum entanglement in the ground state

✍ François Fillaux 📂 Article 📅 2004 🏛 Elsevier Science 🌐 English ⚖ 576 KB

Mechanisms of the Elementary Processes o

Mechanisms of the Elementary Processes of Electron Wavepacket Dynamics Coupled with Proton Transfer and Hydrogen-Atom Migration in H2O+H3O+

✍ Hiroshi Ushiyama; Kazuo Takatsuka 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 193 KB 👁 2 views

Mechanisms of the Elementary Processes o

Mechanisms of the Elementary Processes of Electron Wavepacket Dynamics Coupled with Proton Transfer and Hydrogen-Atom Migration in H2O+H3O+

✍ Hiroshi Ushiyama; Kazuo Takatsuka 📂 Article 📅 2007 🏛 John Wiley and Sons 🌐 English ⚖ 194 KB 👁 2 views