Search Menu
DOE PAGES title logo U.S. Department of Energy
Office of Scientific and Technical Information
Search Scholarly Publications

Title: Solvent exchange in liquid methanol and rate theory

Authors:
;
Publication Date:
Sponsoring Org.:
USDOE Office of Science (SC), Basic Energy Sciences (BES)
OSTI Identifier:
1358998
Resource Type:
Publisher's Accepted Manuscript
Journal Name:
Chemical Physics Letters
Additional Journal Information:
Journal Name: Chemical Physics Letters Journal Volume: 643 Journal Issue: C; Journal ID: ISSN 0009-2614
Publisher:
Elsevier
Country of Publication:
Netherlands
Language:
English

Citation Formats

Dang, Liem X., and Schenter, Gregory K. Solvent exchange in liquid methanol and rate theory. Netherlands: N. p., 2016. Web. doi:10.1016/j.cplett.2015.10.045.
Copy to clipboard
Dang, Liem X., & Schenter, Gregory K. Solvent exchange in liquid methanol and rate theory. Netherlands. https://doi.org/10.1016/j.cplett.2015.10.045
Copy to clipboard
Dang, Liem X., and Schenter, Gregory K. Fri . "Solvent exchange in liquid methanol and rate theory". Netherlands. https://doi.org/10.1016/j.cplett.2015.10.045.
Copy to clipboard
@article{osti_1358998,
title = {Solvent exchange in liquid methanol and rate theory},
author = {Dang, Liem X. and Schenter, Gregory K.},
abstractNote = {},
doi = {10.1016/j.cplett.2015.10.045},
journal = {Chemical Physics Letters},
number = C,
volume = 643,
place = {Netherlands},
year = {Fri Jan 01 00:00:00 EST 2016},
month = {Fri Jan 01 00:00:00 EST 2016}
}
Copy to clipboard
Journal Article:
Free Publicly Available Full Text
Accepted Manuscript (Publisher)
Publisher's Version of Record
https://doi.org/10.1016/j.cplett.2015.10.045
Copyright Statement
Other availability
Search WorldCat Search WorldCat to find libraries that may hold this journal
Citation Metrics:
Cited by: 5 works
Citation information provided by
Web of Science
Save / Share:
Export Metadata
Save to My Library
You must Sign In or Create an Account in order to save documents to your library.

Works referenced in this record:

Theory of activated rate processes: A new derivation of Kramers’ expression
journal, July 1986

  • Pollak, Eli
  • The Journal of Chemical Physics, Vol. 85, Issue 2
  • DOI: 10.1063/1.451294

The Activated Complex in Chemical Reactions
journal, February 1935

  • Eyring, Henry
  • The Journal of Chemical Physics, Vol. 3, Issue 2
  • DOI: 10.1063/1.1749604

Hydration and mobility of ions in solution
journal, December 1983

  • Impey, R. W.; Madden, P. A.; McDonald, I. R.
  • The Journal of Physical Chemistry, Vol. 87, Issue 25
  • DOI: 10.1021/j150643a008

Statistical mechanics of isomerization dynamics in liquids and the transition state approximation
journal, January 1978

  • Chandler, David
  • The Journal of Chemical Physics, Vol. 68, Issue 6
  • DOI: 10.1063/1.436049

Understanding the Rates and Molecular Mechanism of Water-Exchange around Aqueous Ions Using Molecular Simulations
journal, June 2014

  • Annapureddy, Harsha V. R.; Dang, Liem X.
  • The Journal of Physical Chemistry B, Vol. 118, Issue 30
  • DOI: 10.1021/jp502922c

Many-body interactions in liquid methanol and its liquid/vapor interface: A molecular dynamics study
journal, November 2003

  • Dang, Liem X.; Chang, Tsun-Mei
  • The Journal of Chemical Physics, Vol. 119, Issue 18
  • DOI: 10.1063/1.1615957

Dynamic solvent effects on activated chemical reactions Part II.—Quantum mechanical effects
journal, January 1997

  • McRae, Robin P.; Schenter, Gregory K.; Garrett, Bruce C.
  • Journal of the Chemical Society, Faraday Transactions, Vol. 93, Issue 5
  • DOI: 10.1039/a605914g

Dynamics of ion pair interconversion in a polar solvent
journal, November 1990

  • Ciccotti, Giovanni; Ferrario, Mauro; Hynes, James T.
  • The Journal of Chemical Physics, Vol. 93, Issue 10
  • DOI: 10.1063/1.459437

Current status of transition-state theory
journal, July 1983

  • Truhlar, Donald G.; Hase, William L.; Hynes, James T.
  • The Journal of Physical Chemistry, Vol. 87, Issue 15
  • DOI: 10.1021/j100238a003

Variational transition state theory for activated chemical reactions in solution
journal, September 1994

  • Garrett, Bruce C.; Schenter, Gregory K.
  • International Reviews in Physical Chemistry, Vol. 13, Issue 2
  • DOI: 10.1080/01442359409353296

Dynamic solvent effects on activated chemical reactions. I. Classical effects of reaction path curvature
journal, December 1992

  • Schenter, Gregory K.; McRae, Robin P.; Garrett, Bruce C.
  • The Journal of Chemical Physics, Vol. 97, Issue 12
  • DOI: 10.1063/1.463970

Inorganic and Bioinorganic Solvent Exchange Mechanisms
journal, June 2005

  • Helm, Lothar; Merbach, André E.
  • Chemical Reviews, Vol. 105, Issue 6
  • DOI: 10.1021/cr030726o

Ring-Polymer Molecular Dynamics: Quantum Effects in Chemical Dynamics from Classical Trajectories in an Extended Phase Space
journal, April 2013

On the Residence Time for Water in a Solute Hydration Shell: Application to Aqueous Halide Solutions
journal, July 2008

  • Laage, Damien; Hynes, James T.
  • The Journal of Physical Chemistry B, Vol. 112, Issue 26
  • DOI: 10.1021/jp802033r

Variational Transition State Theory
journal, October 1984

Classical and quantum mechanical studies of ice Ih near the melting temperature
journal, January 1996

  • Gai, Huadong; Schenter, Gregory K.; Garrett, Bruce C.
  • The Journal of Chemical Physics, Vol. 104, Issue 2
  • DOI: 10.1063/1.470864

A smooth particle mesh Ewald method
journal, November 1995

  • Essmann, Ulrich; Perera, Lalith; Berkowitz, Max L.
  • The Journal of Chemical Physics, Vol. 103, Issue 19
  • DOI: 10.1063/1.470117

The stable states picture of chemical reactions. II. Rate constants for condensed and gas phase reaction models
journal, September 1980

  • Grote, Richard F.; Hynes, James T.
  • The Journal of Chemical Physics, Vol. 73, Issue 6
  • DOI: 10.1063/1.440485

Chemical Reaction Dynamics in Solution
journal, October 1985

Numerical integration of the cartesian equations of motion of a system with constraints: molecular dynamics of n-alkanes
journal, March 1977

  • Ryckaert, Jean-Paul; Ciccotti, Giovanni; Berendsen, Herman J. C.
  • Journal of Computational Physics, Vol. 23, Issue 3
  • DOI: 10.1016/0021-9991(77)90098-5

Potential of mean force by constrained molecular dynamics: A sodium chloride ion-pair in water
journal, August 1991

A dynamical theory of unimolecular ionic dissociation reactions in polar solvents
journal, February 1988

  • Zichi, Dominic A.; Hynes, James T.
  • The Journal of Chemical Physics, Vol. 88, Issue 4
  • DOI: 10.1063/1.454030

Water exchange on metal ions: experiments and simulations
journal, June 1999

    Sort by:
    [ × clear filter / sort ]

    Similar Records in DOE PAGES and OSTI.GOV collections: