2019
DOI: 10.7498/aps.68.20182121
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Spectrum and dissociation properties of fluoro trichloro methane molecule in radiational field

Abstract: The ozone layer in the stratosphere of the earth’s atmosphere, which can be destroyed by CFC-11 molecule, plays a crucial role in human survival because it can absorb most of the harmful radiation from the sun and effectively protect the earth’s biology. Therefore, it is of evident significance to investigate the properties of CFC-11 molecule. By Motivated by this and the adoption of B3LYP complex function at a level of 6-311++g(3df, 3pd) basis set, we carry out a series of theoretical studies of the Freon mat… Show more

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Cited by 1 publication
(2 citation statements)
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“…In other words, the molecule was polarized by the electric field, and the dipole moment decreased and then increased. On equation, Hint = -μF, the molecular dipole moment decreased initially and then increased, so the Hamiltonian increased initially and then decreased, and the total energy of the molecular increased initially and then decreased [22] .…”
Section: Total Energy and Dipole Momentmentioning
confidence: 99%
See 1 more Smart Citation
“…In other words, the molecule was polarized by the electric field, and the dipole moment decreased and then increased. On equation, Hint = -μF, the molecular dipole moment decreased initially and then increased, so the Hamiltonian increased initially and then decreased, and the total energy of the molecular increased initially and then decreased [22] .…”
Section: Total Energy and Dipole Momentmentioning
confidence: 99%
“…At present, the only way to degrade phosgene is by thermal decomposition [19] . Degradation via external electric field is a new idea that has been applied to the study of halon molecules and methane derivatives [20][21][22] . The conditions required for electric field degradation are minimal, which is convenient for industrial applications.…”
Section: Introductionmentioning
confidence: 99%