STABILITY ANALYSIS AND STUDY OF ETHYLENE GLYCOL MONOMER AND DIMER COMPLEX

Authors

  • Abubakir Shermatov Master degree Student, Samarkand State University of Uzbekistan
  • Mirjavokhir Mirov Master degree Student, Samarkand State University of Uzbekistan
  • Shakhzod Tojiyev, Master degree Student, Samarkand State University of Uzbekistan

Keywords:

ethylene glycol,, monomer,, dimer,, interaction energy, frequency,

Abstract

A detailed theoretical study of ethylene glycol molecule have been performed by
Hartree Fock (HF) method, second-order Møller-Plesset perturbation theory (MP2), and density
functional theory (DFT) using 6-311++G(d,p) basis set. Geometrical parameters, interaction
energies, deviation of potential energy curves of hydrogen bonded O–H from that of free O–H,
and charge transfer have been studied to analyze stability and nature of hydrogen bond
formation molecule of ethylene glycol dimer complex.

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Published

2021-12-30

How to Cite

Abubakir Shermatov, Mirjavokhir Mirov, & Shakhzod Tojiyev,. (2021). STABILITY ANALYSIS AND STUDY OF ETHYLENE GLYCOL MONOMER AND DIMER COMPLEX. International Scientific and Current Research Conferences, 1(1), 104–107. Retrieved from https://www.orientalpublication.com/index.php/iscrc/article/view/303

Issue

INNOVATIVE DEVELOPMENT DISCOURSE MODERN SCIENCE AND EDUCATION

Section

Articles

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Copyright (c) 2021 Abubakir Shermatov, Mirjavokhir Mirov, Shakhzod Tojiyev,

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