Global Science Press: Vol. 2 (2014), Issue 1

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Vol. 2 (2014), Issue 1

Vol. 2 (2014), Issue 1

Journal Issue

Year: 2014

Communications in Computational Chemistry, Vol. 2 (2014)

A Post-Processing Program for ReaxFF Simulation of Chemical Structural Model of Coal

Journal Article

A Post-Processing Program for ReaxFF Simulation of Chemical Structural Model of Coal

Communications in Computational Chemistry, Vol. 2 (2014), Iss. 1 : pp. 1–8

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The Velocity Gauge KFR Ionization Rates of H(2<em>p<sub>x</sub></em>), H(2<em>p<sub>y</sub></em>) and H(2<em>p<sub>z</sub></em>) Atom in the Linear Polarized Laser Field

Journal Article

The Velocity Gauge KFR Ionization Rates of H(2<em>p<sub>x</sub></em>), H(2<em>p<sub>y</sub></em>) and H(2<em>p<sub>z</sub></em>) Atom in the Linear Polarized Laser Field

Communications in Computational Chemistry, Vol. 2 (2014), Iss. 1 : pp. 9–21

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DFT Study of the Catalytic Mechanism for Urethane Formation in the Presence of Basic Catalyst 1,4-Diazabicyclo[2.2.2]Octane

Journal Article

DFT Study of the Catalytic Mechanism for Urethane Formation in the Presence of Basic Catalyst 1,4-Diazabicyclo[2.2.2]Octane

Communications in Computational Chemistry, Vol. 2 (2014), Iss. 1 : pp. 22–35

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Quantum Wave Packet Dynamics of the N(<sup>2</sup>D)+H<sub>2</sub> Reaction

Journal Article

Quantum Wave Packet Dynamics of the N(<sup>2</sup>D)+H<sub>2</sub> Reaction

Communications in Computational Chemistry, Vol. 2 (2014), Iss. 1 : pp. 36–46

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