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Journal of Modern Physics
Volume 4, Number 3A, March 2013 (Special Issue on Density Functional Theory)
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Theoretical Study on the Optical and Electrical Properties of AlxGa1-xN Crystals ()
Xuewen Wang, Yuzhou Jing, Xinkang Zhu, Chan Liu, Jiangni Yun, Zhiyong Zhang
Journal of Modern Physics Vol.4 No.3A, March 29, 2013
DOI: 10.4236/jmp.2013.43A063 3,297 Downloads 5,247 Views Citations This article belongs to the Special Issue on
DFT Study on Reaction Mechanism of DNA Base Pair with Hydroxyl Radical ()
Eisuke Shimizu, Ryota Hoshino, Kazuya Nomura, Victor I. Danilov, Noriyuki Kurita
DOI: 10.4236/jmp.2013.43A062 4,458 Downloads 7,551 Views Citations This article belongs to the Special Issue on
Stair Magnetism: Distinct Magnetic States of Co5C5 Carbide Isomers ()
Andrew Kuznetsov
DOI: 10.4236/jmp.2013.43A061 4,751 Downloads 7,713 Views Citations This article belongs to the Special Issue on
A DFT Calculation of Nb and Ta (001) Surface Properties ()
Amall Ahmed Ramanathan
DOI: 10.4236/jmp.2013.43A060 3,705 Downloads 6,061 Views Citations This article belongs to the Special Issue on
DFT Calculations on the Effect of Solvation on the Tautomeric Reactions for Wobble Gua-Thy and Canonical Gua-Cyt Base-Pairs ()
Kazuya Nomura, Ryota Hoshino, Eisuke Shimizu, Yasuhiro Hoshiba, Victor I. Danilov, Noriyuki Kurita
DOI: 10.4236/jmp.2013.43A059 3,911 Downloads 6,089 Views Citations This article belongs to the Special Issue on
Magnetism of Co13-Filled Carbon Nanotubes of Diverse Chiral Symmetry ()
DOI: 10.4236/jmp.2013.43A058 4,781 Downloads 7,496 Views Citations This article belongs to the Special Issue on
A Density Functional Theory Study of Methoxy and Atomic Hydrogen Chemisorption on Au(100) Surface ()
M. N’dollo, P. S. Moussounda, T. Dintzer, F. Garin
DOI: 10.4236/jmp.2013.43A057 4,057 Downloads 6,509 Views Citations This article belongs to the Special Issue on
Dimensionality Effects in Dipolar Fluids: A Density Functional Theory Study ()
Remi Geiger, Sabine H. L. Klapp
DOI: 10.4236/jmp.2013.43A056 3,607 Downloads 5,835 Views Citations This article belongs to the Special Issue on
Functional N-Representability in 2-Matrix, 1-Matrix, and Density Functional Theories ()
Eduardo V. Ludeña, F. Javier Torres, Cesar Costa
DOI: 10.4236/jmp.2013.43A055 4,826 Downloads 8,309 Views Citations This article belongs to the Special Issue on
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