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- W2346877715 abstract "The FTIR spectra of fluoroform trapped in argon and nitrogen matrixes are studied at T ∼ 10–30 K. The bands of E symmetry show the splitting effect in a nitrogen matrix, which is absent in an argon matrix. The effect is the most prominent in the case of the ν4 CH bending vibration. It decreases slightly with increasing temperature. Both static and Car–Parrinello molecular dynamic simulations suggest that the degeneracy lifting is due to C3v symmetry lowering caused by interactions between fluoroform and all neighbor N2 matrix molecules." @default.
- W2346877715 created "2016-06-24" @default.
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- W2346877715 date "2016-05-17" @default.
- W2346877715 modified "2023-10-16" @default.
- W2346877715 title "Degeneracy Lifting Effect in the FTIR Spectrum of Fluoroform Trapped in a Nitrogen Matrix. An Experimental and Car–Parrinello Molecular Dynamics Study" @default.
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- W2346877715 doi "https://doi.org/10.1021/acs.jpca.6b02039" @default.
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