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There are 1510302 results for: content related to: Ab initio molecular dynamics approach to tunneling splitting in polyatomic molecules

  1. You have free access to this content
    Reactions that involve tunneling by carbon and the role that calculations have played in their study

    Wiley Interdisciplinary Reviews: Computational Molecular Science

    Volume 6, Issue 1, January/February 2016, Pages: 20–46, Weston Thatcher Borden

    Version of Record online : 25 NOV 2015, DOI: 10.1002/wcms.1235

  2. Theoretical aspects of tunneling proton transfer reactions in a polar environment

    Journal of Physical Organic Chemistry

    Volume 23, Issue 7, July 2010, Pages: 632–646, Philip M. Kiefer and James T. Hynes

    Version of Record online : 22 JUN 2010, DOI: 10.1002/poc.1710

  3. Resonant Tunneling

    Standard Article

    Encyclopedia of Applied Physics

    E. E. Mendez and L. Esaki

    Published Online : 15 APR 2003, DOI: 10.1002/3527600434.eap400

  4. Tunneling in enzymatic and nonenzymatic hydrogen transfer reactions

    Journal of Physical Organic Chemistry

    Volume 23, Issue 7, July 2010, Pages: 660–676, Donald G. Truhlar

    Version of Record online : 30 MAR 2010, DOI: 10.1002/poc.1676

  5. Atom Tunneling in Chemistry

    Angewandte Chemie International Edition

    Volume 55, Issue 18, April 25, 2016, Pages: 5400–5413, Jan Meisner and Prof. Dr. Johannes Kästner

    Version of Record online : 16 MAR 2016, DOI: 10.1002/anie.201511028

  6. Nanoscale Characterization of Surfaces and Interfaces

    Standard Article

    Materials Science and Technology

    N. John DiNardo

    Published Online : 15 SEP 2006, DOI: 10.1002/9783527603978.mst0020

  7. Business Groups and Tunneling: Evidence from Private Securities Offerings by Korean Chaebols

    The Journal of Finance

    Volume 61, Issue 5, October 2006, Pages: 2415–2449, JAE-SEUNG BAEK, JUN-KOO KANG and INMOO LEE

    Version of Record online : 19 SEP 2006, DOI: 10.1111/j.1540-6261.2006.01062.x

  8. DOIT: a program to calculate thermal rate constants and mode-specific tunneling splittings directly from quantum-chemical calculations

    Journal of Computational Chemistry

    Volume 22, Issue 7, May 2001, Pages: 787–801, Zorka Smedarchina, Antonio Fernández-Ramos and Willem Siebrand

    Version of Record online : 9 APR 2001, DOI: 10.1002/jcc.1043

  9. Path Length Determines the Tunneling Decay of Substituted Carbenes

    Chemistry - A European Journal

    Volume 19, Issue 25, June 17, 2013, Pages: 8207–8212, Prof. Dr. Johannes Kästner

    Version of Record online : 22 APR 2013, DOI: 10.1002/chem.201203651

  10. Mode-Selective Promotion and Isotope Effects of Concerted Double-Hydrogen Tunneling in Porphycene Embedded in Superfluid Helium Nanodroplets

    ChemPhysChem

    Volume 10, Issue 5, March 23, 2009, Pages: 761–765, Alexander Vdovin, Jacek Waluk, Bernhard Dick and Alkwin Slenczka

    Version of Record online : 19 FEB 2009, DOI: 10.1002/cphc.200900022

  11. Reaction path Hamiltonian and the unified reaction valley approach

    Wiley Interdisciplinary Reviews: Computational Molecular Science

    Volume 1, Issue 4, July/August 2011, Pages: 531–556, Elfi Kraka

    Version of Record online : 6 MAY 2011, DOI: 10.1002/wcms.65

  12. Heavy atom motions and tunneling in hydrogen transfer reactions: the importance of the pre-tunneling state

    Journal of Physical Organic Chemistry

    Volume 23, Issue 7, July 2010, Pages: 586–605, Hans-Heinrich Limbach, K. Barbara Schowen and Richard L. Schowen

    Version of Record online : 27 MAY 2010, DOI: 10.1002/poc.1663

  13. Ensemble-averaged variational transition state theory with optimized multidimensional tunneling for enzyme kinetics and other condensed-phase reactions

    International Journal of Quantum Chemistry

    Volume 100, Issue 6, 20 December 2004, Pages: 1136–1152, Donald G. Truhlar, Jiali Gao, Mireia Garcia-Viloca, Cristobal Alhambra, Jose Corchado, Maria Luz Sanchez and Tina D. Poulsen

    Version of Record online : 30 AUG 2004, DOI: 10.1002/qua.20205

  14. Magnetic Tunnel Junctions

    Standard Article

    Handbook of Magnetism and Advanced Magnetic Materials

    Stuart Parkin, Hyunsoo Yang, See-Hun Yang and Masamitsu Hayashi

    Published Online : 15 DEC 2007, DOI: 10.1002/9780470022184.hmm509

  15. You have free access to this content
    A new conceptual framework for enzyme catalysis

    European Journal of Biochemistry

    Volume 269, Issue 13, July 2002, Pages: 3096–3102, Michael J. Sutcliffe and Nigel S. Scrutton

    Version of Record online : 4 AUG 2009, DOI: 10.1046/j.1432-1033.2002.03020.x

  16. Zener Effect

    Standard Article

    Wiley Encyclopedia of Electrical and Electronics Engineering

    Felix A. Buot

    Published Online : 31 JAN 2014, DOI: 10.1002/047134608X.W3235.pub3

  17. You have free access to this content
    On the delay of single-electron logic devices

    International Journal of Circuit Theory and Applications

    Volume 41, Issue 6, June 2013, Pages: 563–572, J. Hoekstra

    Version of Record online : 28 MAR 2012, DOI: 10.1002/cta.1802

  18. The Multistep Tunneling Analogue of Conductivity Mismatch in Organic Spin Valves

    Advanced Functional Materials

    Volume 22, Issue 6, March 21, 2012, Pages: 1180–1189, T. Lan Anh Tran, T. Quyen Le, Johnny G. M. Sanderink, Wilfred G. van der Wiel and Michel P. de Jong

    Version of Record online : 31 JAN 2012, DOI: 10.1002/adfm.201102584

  19. Semiclassical Theory for Dissipative Tunneling Through a Molecular Wire

    Annals of the New York Academy of Sciences

    Volume 960, Issue 1, April 2002, Pages: 240–247, ALEXANDER L. BURIN, YURI A. BERLIN and MARK A. RATNER

    Version of Record online : 24 JAN 2006, DOI: 10.1111/j.1749-6632.2002.tb03038.x

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    Kimihiko Hirao: List of publications

    International Journal of Quantum Chemistry

    Volume 109, Issue 9, 2009, Pages: 1770–1789,

    Version of Record online : 23 MAR 2009, DOI: 10.1002/qua.22195