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Article: Ab Initio Research on a New Type of Half-Metallic Double Perovskites, A2CrMO6 (A = IVA Group Elements; M = Mo, Re and W)
Computation 2014, 2(1), 12-22; doi:10.3390/computation2010012 - published online 21 March 2014
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Letter: Linear Scaling Solution of the Time-Dependent Self-Consistent-Field Equations
Computation 2014, 2(1), 1-11; doi:10.3390/computation2010001 - published online 14 March 2014
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Article: Second-Row Transition-Metal Doping of (ZniSi), i = 12, 16 Nanoclusters: Structural and Magnetic Properties
Computation 2013, 1(3), 31-45; doi:10.3390/computation1030031 - published online 14 November 2013
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Editorial: Computation: A New Open Access Journal of Computational Chemistry, Computational Biology and Computational Engineering
Computation 2013, 1(2), 27-30; doi:10.3390/computation1020027 - published online 4 September 2013
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Article: Structural Features That Stabilize ZnO Clusters: An Electronic Structure Approach
Computation 2013, 1(1), 16-26; doi:10.3390/computation1010016 - published online 31 May 2013
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Article: Effect of Isotopic Substitution on Elementary Processes in Dye-Sensitized Solar Cells: Deuterated Amino-Phenyl Acid Dyes on TiO2
Computation 2013, 1(1), 1-15; doi:10.3390/computation1010001 - published online 11 March 2013
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