Title of article
Investigating the Energy Efficiency of TEX High Energy Derivatives with Different Carbon Fuller Nano Structures under Different Temperature Conditions by DFT Method
Author/Authors
Lgaz ، Helen - An-Najah National University
Pages
7
From page
98
To page
104
Abstract
In this study, high energy energy derivatives of TEX with different carboncontaining fullerenes at different temperature conditions were studied using density functional theory. For this purpose, the materials were first geometric optimized, then the thermodynamic parameters were calculated for all of them. Then, the process of changing the energydependent parameters such as specific heat capacity, enthalpy, entropy and Gibbs free energy relative to molecular mass, molecular volume and measured level in this study at a given temperature, were evaluated against each other.
Keywords
High energy energy derivatives , TEX , Functional density theory
Journal title
International Journal of new Chemistry
Serial Year
2016
Journal title
International Journal of new Chemistry
Record number
2466368
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