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There are 7406318 results for: content related to: On the anharmonic vibrations in crystalline silicon

  1. Anharmonic Effect of the Unimolecular Dissociation of HFCO and DFCO

    Journal of the Chinese Chemical Society

    Volume 62, Issue 7, July 2015, Pages: 582–591, Jingjun Zhong, Weiwen Wang, Qian Li, Wenwen Xia, Ying Shao, Li Yao and S. H. Lin

    Version of Record online : 12 JUN 2015, DOI: 10.1002/jccs.201400127

  2. Toward anharmonic computations of vibrational spectra for large molecular systems

    International Journal of Quantum Chemistry

    Volume 112, Issue 9, 5 May 2012, Pages: 2185–2200, Vincenzo Barone, Malgorzata Biczysko, Julien Bloino, Monika Borkowska-Panek, Ivan Carnimeo and Pawel Panek

    Version of Record online : 30 AUG 2011, DOI: 10.1002/qua.23224

  3. Anharmonic molecular force fields

    Wiley Interdisciplinary Reviews: Computational Molecular Science

    Volume 2, Issue 2, March/April 2012, Pages: 273–289, Attila G. Császár

    Version of Record online : 12 JUL 2011, DOI: 10.1002/wcms.75

  4. Anharmonic Effect of the Unimolecular Isomerization/Decomposition of Benzyne

    Journal of the Chinese Chemical Society

    Volume 62, Issue 4, April 2015, Pages: 355–365, Qian Li, Li Yao and S. H. Lin

    Version of Record online : 16 MAR 2015, DOI: 10.1002/jccs.201400345

  5. Anharmonic Effect of the Unimolecular Dissociation of Ethyl Radical

    Journal of the Chinese Chemical Society

    Volume 61, Issue 3, March 2014, Pages: 309–319, Qian Li, Li Yao, Ying Shao and Kun Yang

    Version of Record online : 2 JAN 2014, DOI: 10.1002/jccs.201300277

  6. Efficient Calculation of Anharmonic Vibrational Spectra of Large Molecules with Localized Modes

    ChemPhysChem

    Volume 15, Issue 15, October 20, 2014, Pages: 3365–3377, Paweł T. Panek and Dr. Christoph R. Jacob

    Version of Record online : 30 JUL 2014, DOI: 10.1002/cphc.201402251

  7. Anharmonic Effects in Heat Capacity and Saturation Vapour Pressure of Dilute Substitutional Alloys

    physica status solidi (b)

    Volume 73, Issue 2, 1 February 1976, Pages: 401–408, S. I. Masharov

    Version of Record online : 7 FEB 2006, DOI: 10.1002/pssb.2220730203

  8. Thermodynamic modelling of crystalline unary phases

    physica status solidi (b)

    Volume 251, Issue 1, January 2014, Pages: 14–32, M. Palumbo, B. Burton, A. Costa e Silva, B. Fultz, B. Grabowski, G. Grimvall, B. Hallstedt, O. Hellman, B. Lindahl, A. Schneider, P. E. A. Turchi and W. Xiong

    Version of Record online : 21 DEC 2013, DOI: 10.1002/pssb.201350133

  9. Generalized atomic displacements in crystallographic structure analysis

    Acta Crystallographica Section A

    Volume 48, Issue 2, March 1992, Pages: 80–98, W. F. Kuhs

    DOI: 10.1107/S0108767391009510

  10. Harmonicity and anharmonicity in protein dynamics: A normal mode analysis and principal component analysis

    Proteins: Structure, Function, and Bioinformatics

    Volume 23, Issue 2, October 1995, Pages: 177–186, Steven Hayward, Akio Kitao and Professor Nobuhiro Gō

    Version of Record online : 3 FEB 2004, DOI: 10.1002/prot.340230207

  11. Anharmonic Effect of N-Propyl Peroxy Dissociation

    Journal of the Chinese Chemical Society

    Volume 63, Issue 12, December 2016, Pages: 1038–1050, Liguo Song, Xinxiang Pan, Qian Li, Yang Ding, Li Yao and Sheng-Hsien Lin

    Version of Record online : 18 NOV 2016, DOI: 10.1002/jccs.201600091

  12. You have full text access to this OnlineOpen article
    Generalized vibrational perturbation theory for rotovibrational energies of linear, symmetric and asymmetric tops: Theory, approximations, and automated approaches to deal with medium-to-large molecular systems

    International Journal of Quantum Chemistry

    Volume 115, Issue 15, August 5, 2015, Pages: 948–982, Matteo Piccardo, Julien Bloino and Vincenzo Barone

    Version of Record online : 10 JUN 2015, DOI: 10.1002/qua.24931

  13. On the Calculation of the Anharmonic Effect of Unimolecular Reactions of HOCO

    Journal of the Chinese Chemical Society

    Volume 59, Issue 8, August 2012, Pages: 953–960, Lingzheng Gu, Wenwen Xia, Xinting Huang, Li Yao, Ying Shao and Kun Yang

    Version of Record online : 29 MAY 2012, DOI: 10.1002/jccs.201100600

  14. The Backward Trip: From The Vibration-Rotation Data to The Hamiltonian

    Advances in Chemical Physics, Volume 108

    Michel Herman, Jacques Lievin, Jean Vander Auwera, Alain Campargue, I. Prigogine, Stuart A. Rice, Pages: 95–253, 2007

    Published Online : 14 MAR 2007, DOI: 10.1002/9780470141670.ch3

  15. Anharmonic Effects in the Thermal Diffuse Scattering of X-Rays

    physica status solidi (b)

    Volume 167, Issue 2, 1 October 1991, Pages: 417–428, A. G. Tsarkov and V. G. Tsirelson

    Version of Record online : 19 FEB 2006, DOI: 10.1002/pssb.2221670204

  16. Infrared Absorption in Anharmonic Crystals with Impurities: An Application to a Diatomic Linear KI-Chain

    physica status solidi (b)

    Volume 186, Issue 1, 1 November 1994, Pages: 101–117, Th. Held, W. Kuhn and I. Pfeiffer

    Version of Record online : 15 FEB 2006, DOI: 10.1002/pssb.2221860108

  17. Investigations of Bijvoet Differences and Anharmonicity in Gallium Phosphide

    physica status solidi (b)

    Volume 165, Issue 1, 1 May 1991, Pages: 67–74, R. Saravanan, S. K. Mohanlal and K. S. Chandrasekaran

    Version of Record online : 19 FEB 2006, DOI: 10.1002/pssb.2221650103

  18. Event detection and sub-state discovery from biomolecular simulations using higher-order statistics: Application to enzyme adenylate kinase

    Proteins: Structure, Function, and Bioinformatics

    Volume 80, Issue 11, November 2012, Pages: 2536–2551, Arvind Ramanathan, Andrej J. Savol, Pratul K. Agarwal and Chakra S. Chennubhotla

    Version of Record online : 8 AUG 2012, DOI: 10.1002/prot.24135

  19. The anharmonic behavior of the oxygen modes in YBa2Cu3Ox compounds

    Journal of Raman Spectroscopy

    Volume 32, Issue 10, October 2001, Pages: 821–826, E. Liarokapis, D. Palles, K. Conder and E. Kaldis

    Version of Record online : 8 OCT 2001, DOI: 10.1002/jrs.771

  20. Study of Certain Aspects of Anharmonic, Time-Dependent and Damped Harmonic Oscillator Systems

    Fortschritte der Physik/Progress of Physics

    Volume 37, Issue 10, 1989, Pages: 761–818, S. K. Bose, U. B. Dubey and N. Varma

    Version of Record online : 15 FEB 2006, DOI: 10.1002/prop.2190371002