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Volume & Issue: Volume 5, Issue 1, January 2018, Pages 1-39 

Research Paper

1. Evaluating the Performance of 2,3-dihydro-1H-phenothiazine-4(5aH)-one as an Ionophore in Construction of a Cation Selective Electrode by Density Functional Theory

Pages 1-10

10.22034/ijnc.2018.30985

Mohammad Reza Jalali Sarvestani; Roya Ahmadi

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  • PDF 792.56 K

2. Computational Study of the Mass, Volume and Surface Effects on the Energetic Properties of RDX Derivatives with Different Fullerenes (C20, C24 and C60)

Pages 11-17

10.22034/ijnc.2018.32294

Somayeh Pourkarim; Hamideh Shahzad

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  • PDF 1.38 MB

3. The Effect of B12N12 Substitution on the Properties of TEX Energetic Materials in Different Temperature Conditions: A DFT Study

Pages 18-25

10.22034/ijnc.2018.32295

Mohammad Reza Jalali Sarvestani; Tahereh Boroushaki; Mehdi Ezzati

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  • PDF 1.21 MB

4. The Energetic, Check of Derived Boron Nitride Nano- cage with (HMX) in Different Conditions of Temperature by Density Functional Theory Method

Pages 26-32

10.22034/ijnc.2018.32296

Mehdi Ezzati; Roya Ahmadi; Tahereh Boroushaki; Elaheh Sadat MirKamali; Behnam Farhang

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  • PDF 1.01 MB

5. Theoretical Study of Chemical Properties of Fulleromethyldopa and Derivatives

Pages 33-39

10.22034/ijnc.2018.32298

Mandana Pirahan Foroush; Laleh Alah Karam

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  • PDF 316.26 K

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