• 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