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There are 33433 results for: content related to: Inside Cover, Volume 114, Issue 1

  1. You have free access to this content
    Opening the Pandora's jar of molecule-to-material conversion in chemical vapor deposition: Insights from theory

    International Journal of Quantum Chemistry

    Volume 114, Issue 1, 5 January 2014, Pages: 1–7, Gloria Tabacchi, Ettore Fois, Davide Barreca and Alberto Gasparotto

    Version of Record online : 2 JUL 2013, DOI: 10.1002/qua.24505

  2. You have free access to this content
    Cover Image, Volume 114, Issue 1

    International Journal of Quantum Chemistry

    Volume 114, Issue 1, 5 January 2014, Pages: i–ii,

    Version of Record online : 22 NOV 2013, DOI: 10.1002/qua.24583

  3. H-bond and electric field correlations for water in highly hydrated crystals

    International Journal of Quantum Chemistry

    Volume 116, Issue 2, January 15, 2016, Pages: 67–80, Anik Sen, Pavlin D. Mitev, Anders Eriksson and Kersti Hermansson

    Version of Record online : 11 DEC 2015, DOI: 10.1002/qua.25022

  4. Spherical confinement of coulombic systems inside an impenetrable box: H atom and the Hulthén potential

    International Journal of Quantum Chemistry

    Volume 115, Issue 15, August 5, 2015, Pages: 937–947, Amlan K. Roy

    Version of Record online : 10 MAY 2015, DOI: 10.1002/qua.24929

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    Development of the potential energy surface and current stage of the quantum dynamics studies of the F + H2/HD reaction

    International Journal of Quantum Chemistry

    Volume 115, Issue 11, June 5, 2015, Pages: 689–699, Zhigang Sun and Dong H. Zhang

    Version of Record online : 6 MAR 2015, DOI: 10.1002/qua.24895

  6. Theoretical study of atoms by the electronic kinetic energy density and stress tensor density

    International Journal of Quantum Chemistry

    Volume 116, Issue 7, April 5, 2016, Pages: 504–514, Hiroo Nozaki, Kazuhide Ichikawa and Akitomo Tachibana

    Version of Record online : 8 JAN 2016, DOI: 10.1002/qua.25073

  7. You have free access to this content
    Inside Cover, Volume 114, Issue 15

    International Journal of Quantum Chemistry

    Volume 114, Issue 15, 5 August 2014, Pages: iii–iv,

    Version of Record online : 16 JUN 2014, DOI: 10.1002/qua.24723

  8. The Reality Checkup

    Pseudoscience and Extraordinary Claims of the Paranormal: A Critical Thinker's Toolkit

    Jonathan C. Smith, Pages: 319–339, 2009

    Published Online : 6 NOV 2009, DOI: 10.1002/9781444310122.ch16

  9. HONPAS: A linear scaling open-source solution for large system simulations

    International Journal of Quantum Chemistry

    Volume 115, Issue 10, May 15, 2015, Pages: 647–655, Xinming Qin, Honghui Shang, Hongjun Xiang, Zhenyu Li and Jinlong Yang

    Version of Record online : 2 DEC 2014, DOI: 10.1002/qua.24837

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    Density matrix renormalization group for ab initio Calculations and associated dynamic correlation methods: A review of theory and applications

    International Journal of Quantum Chemistry

    Volume 115, Issue 5, March 5, 2015, Pages: 283–299, Takeshi Yanai, Yuki Kurashige, Wataru Mizukami, Jakub Chalupský, Tran Nguyen Lan and Masaaki Saitow

    Version of Record online : 22 OCT 2014, DOI: 10.1002/qua.24808

  11. You have free access to this content
    Inside Cover, Volume 114, Issue 8

    International Journal of Quantum Chemistry

    Volume 114, Issue 8, 15 April 2014, Pages: iii–iv,

    Version of Record online : 3 MAR 2014, DOI: 10.1002/qua.24660

  12. Density functional study of organocatalytic mannich-type reactions: Insight into reverse diastereoselectivities arising from catalysts with different scaffolds

    International Journal of Quantum Chemistry

    Volume 115, Issue 6, March 15, 2015, Pages: 398–405, Changke Tian, Aiping Fu, Chengyan Zhao, Hongliang Li, Zonghua Wang and Yunbo Duan

    Version of Record online : 5 JAN 2015, DOI: 10.1002/qua.24859

  13. You have free access to this content
    Inside Cover, Volume 114, Issue 20

    International Journal of Quantum Chemistry

    Volume 114, Issue 20, October 15, 2014, Pages: iii–iv,

    Version of Record online : 2 SEP 2014, DOI: 10.1002/qua.24756

  14. A perspective on the relative merits of time-dependent and time-independent density functional theory in studies of the electron spectra due to transition metal complexes. An illustration through applications to copper tetrachloride and plastocyanin

    International Journal of Quantum Chemistry

    Volume 114, Issue 15, 5 August 2014, Pages: 1019–1029, Hristina R. Zhekova, Michael Seth and Tom Ziegler

    Version of Record online : 6 FEB 2014, DOI: 10.1002/qua.24624

  15. Ab initio spectroscopic study for the NaRb molecule in ground and excited states

    International Journal of Quantum Chemistry

    Volume 114, Issue 11, 5 June 2014, Pages: 731–747, Maha Chaieb, Héla Habli, Leila Mejrissi, Brahim Oujia and Florent Xavier Gadéa

    Version of Record online : 13 MAR 2014, DOI: 10.1002/qua.24664

  16. You have free access to this content
    Inside Cover, Volume 114, Issue 2

    International Journal of Quantum Chemistry

    Volume 114, Issue 2, 15 January 2014, Pages: iii–iv,

    Version of Record online : 5 DEC 2013, DOI: 10.1002/qua.24590

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    Hubbard-corrected DFT energy functionals: The LDA+U description of correlated systems

    International Journal of Quantum Chemistry

    Volume 114, Issue 1, 5 January 2014, Pages: 14–49, Burak Himmetoglu, Andrea Floris, Stefano de Gironcoli and Matteo Cococcioni

    Version of Record online : 26 JUL 2013, DOI: 10.1002/qua.24521

  18. You have free access to this content
    Inside Cover, Volume 114, Issue 10

    International Journal of Quantum Chemistry

    Volume 114, Issue 10, 15 May 2014, Pages: iii–iv,

    Version of Record online : 1 APR 2014, DOI: 10.1002/qua.24675

  19. Theoretical study on mechanism of cinchona alkaloids catalyzed asymmetric conjugate addition of dimethyl malonate to β-nitrostyrene

    International Journal of Quantum Chemistry

    Volume 114, Issue 10, 15 May 2014, Pages: 642–651, Haiyang Jiang, Yanwei Sun, Huiling Liu and Xuri Huang

    Version of Record online : 26 FEB 2014, DOI: 10.1002/qua.24646

  20. Backbiting and β-scission reactions in free-radical polymerization of methyl acrylate

    International Journal of Quantum Chemistry

    Volume 114, Issue 5, 5 March 2014, Pages: 345–360, Shi Liu, Sriraj Srinivasan, Michael C. Grady, Masoud Soroush and Andrew M. Rappe

    Version of Record online : 19 NOV 2013, DOI: 10.1002/qua.24572