About: Effect of phonon coupling on hydrogen tunneling rates at gas

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About: Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces Goto Sponge NotDistinct Permalink

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article by Steven E. Wonchoba & Donald Truhlar published 15 December 1993 in Journal of Chemical Physics

Attributes	Values
rdf:type	Item
description	wetenschappelijk artikel (nl) наукова стаття, опублікована в грудні 1993 (uk) article scientifique publié en 1993 (fr) im Dezember 1993 veröffentlichter wissenschaftlicher Artikel (de) article by Steven E. Wonchoba & Donald Truhlar published 15 December 1993 in Journal of Chemical Physics (en)
publication date	wds:Q57402450-A7CB558E-99DE-40E1-8170-3B674A201A54
publication date	1993-12-15 00:00:00Z (xsd:dateTime)
language of work or name	wds:Q57402450-915EFE2A-3DD0-4ABF-912C-26365EEC1DB7
language of work or name	English
cites work	wds:Q57402450-2575D5E2-466B-403A-A0B5-8710EDF449E5 wds:Q57402450-2BE65A8F-0A95-42EC-8704-4361CD1A460B wds:Q57402450-3AC209D6-A4F8-420D-993B-9AFC9BE7E32A wds:Q57402450-42E578A7-497A-4ED9-B49B-96AFFB69546B wds:Q57402450-524973C9-6AD9-49B5-8711-8ADF9762CFE9 wds:Q57402450-697D4DA3-0297-4C90-821B-57C56C86CF33 wds:Q57402450-7CCD6C0A-05F9-4798-91A7-6AECF43E56E3 wds:Q57402450-A386F6AC-BD9D-4FC9-82E2-E7EE025EDE3A wds:Q57402450-B489B904-DFFA-40C3-8847-57890C8E96AB wds:Q57402450-CFAD93E9-6F28-4260-B3C1-F5811C0A70EC wds:Q57402450-E3E7D8BA-BB98-4707-ACEB-D08844E78C08 wds:Q57402450-E4150AA2-2650-457A-ADAF-FD4F3D538CE6 wds:Q57402450-F35458FF-93DB-491B-BFB4-94381CDD3FFB wds:Q57402450-F6EE270F-6176-46E7-9B30-F2D302DC92C5
cites work	Variational transition-state theory Variational Transition State Theory Molecular modeling of the kinetic isotope effect for the [1,5]-sigmatropic rearrangement of cis-1,3-pentadiene Improved treatment of threshold contributions in variational transition-state theory Vibrationally adiabatic models for reactive tunneling A general small-curvature approximation for transition-state-theory transmission coefficients Criterion of minimum state density in the transition state theory of bimolecular reactions POLYRATE 4: A new version of a computer program for the calculation of chemical reaction rates for polyatomics The effects of steps, coupling to substrate vibrations, and surface coverage on surface diffusion rates and kinetic isotope effects: Hydrogen diffusion on Ni Embedded‐cluster model for the effect of phonons on hydrogen surface diffusion on copper Diffusion of hydrogen, deuterium, and tritium on the (100) plane of copper: Reaction-path formulation, variational transition state theory, and tunneling calculations Large tunneling effects in the migration of chemisorbed hydrogen on a metal Surface diffusion of hydrogen on copper: the effect of phonon-adsorbate coupling on the diffusion rate Surface diffusion of H, D, and T on a metal surface: The role of metal motions in the kinetic isotope effects
author name string	wds:Q57402450-A3A076F2-84F6-45B7-AD79-6D5A6E3ECCD1
author name string	Steven E. Wonchoba
rdfs:label	Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (en) Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (nl)
skos:prefLabel	Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (en) Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (nl)
name	Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (en) Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (nl)
author	wds:Q57402450-C38A44C2-E444-4FA1-98DC-566A369D4E46
author	Donald Truhlar
title	wds:Q57402450-013438D5-A427-4054-A9AE-20AE2D83AD2B
title	Effect of phonon coupling on hydrogen tunneling rates at gas–surface interfaces (en)
page(s)	wds:Q57402450-1D8A35DF-D138-449D-A6FB-BD515FB97D13
page(s)	9637-9651
instance of	wds:Q57402450-88A07758-8C90-4923-A006-CB8D4B0CF2DB
instance of	scholarly article
published in	wds:Q57402450-FAC28DF7-561A-4888-BD46-0AC745C6C3FF
published in	Journal of Chemical Physics
issue	wds:Q57402450-84E42658-6327-4ADA-B293-F55F09BE07DB
volume	wds:Q57402450-AC1F0E17-9477-40A0-9D10-37C8F64C514A
issue	12
volume	99
DOI	wds:Q57402450-C5C356FD-8123-42DB-A874-583FD0C544A1
DOI	http://dx.doi.org/10.1063/1.465497
DOI	10.1063/1.465497
is about of	https://www.wikidata.org/wiki/Special:EntityData/Q57402450
is cites work of	Quantum mechanics/molecular mechanics studies of triosephosphate isomerase-catalyzed reactions: effect of geometry and tunneling on proton-transfer rate constants Quantum mechanism in the photodissociation of NaFH complex: a challenge to semiclassical analysis Two-dimensional infrared surface spectroscopy for CO on Cu(100): detection of intermolecular coupling of adsorbates Predicting pressure-dependent unimolecular rate constants using variational transition state theory with multidimensional tunneling combined with system-specific quantum RRK theory: a definitive test for fluoroform dissociation. Quantum-classical dynamics of scattering processes in adiabatic and diabatic representations. Variational transition state theory: theoretical framework and recent developments. Surface diffusion of H on Ni(100): Interpretation of the transition temperature Test of variational transition state theory with multidimensional tunneling contributions against an accurate full-dimensional rate constant calculation for a six-atom system General potential-energy function for H/Ni and dynamics calculations of surface diffusion, bulk diffusion, subsurface-to-surface transport, and absorption Army ants tunneling for classical simulations Nonadiabatic Dynamics of Hydrogen Diffusion on Cu(001): Classical Mapping Model with Multistate Projection Window in Real Space
is cites work of	wds:Q49814547-D6BE80B1-54F2-420A-A80A-CCF239357DF8 wds:Q77789474-FFCC6852-1A7F-44A1-A010-98ADDAB654AE wds:Q57402405-735E6477-71C9-4BF1-95A9-48AE988AE196 wds:Q51993892-7E483D78-7C88-46D3-9A51-CD1DB0266432 wds:Q57401941-AB483444-4FA6-4156-BE0D-D149B7CF729C wds:Q57402351-EBE3292C-621B-4541-B1D1-2FE640A552A2 wds:Q33286902-2FF9FA64-8B94-427F-BA10-523934B8711D wds:Q50631431-0DF0580F-355E-440D-B899-7358259CE47A wds:Q57402421-ABA5B94F-276E-4A6F-894C-279C8B024270 wds:Q57402274-779604D0-243A-44B2-9339-FBA566A79DBD wds:Q93120419-E9B7E0FB-359C-45A6-B68D-7AF9D38C0E69

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