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Volumn 134, Issue 11, 2011, Pages

Strong intermolecular coupling between the HF stretching and H2O bending vibrations in HF:H2O binary amorphous solids: Breakdown of the electrostatic description of the hydrogen bond

Author keywords

[No Author keywords available]

Indexed keywords

AMORPHOUS SOLIDS; AQUEOUS SOLUTIONS; BENDING VIBRATIONS; CLUSTER MODELS; COUPLING MECHANISM; COVALENT CHARACTER; ELECTROSTATIC POTENTIALS; H-BONDS; INFRARED SPECTRUM; INTERMOLECULAR COUPLING; LIQUID WATER; ORDER OF MAGNITUDE; VIBRATIONAL COUPLINGS; VIBRATIONAL ENERGY TRANSFER;

EID: 79953198269     PISSN: 00219606     EISSN: None     Source Type: Journal    
DOI: 10.1063/1.3562368     Document Type: Article
Times cited : (2)

References (23)
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    • -1. Alternatively, this spectral feature also displays several qualitative attributes of a Fano resonance profile (coupling between a discrete bright state and a continuum of bright states) which describes the experimental spectroscopic profile equally well (not shown) and yields similarly large coupling constants
    • -1. Alternatively, this spectral feature also displays several qualitative attributes of a Fano resonance profile (coupling between a discrete bright state and a continuum of bright states) which describes the experimental spectroscopic profile equally well (not shown) and yields similarly large coupling constants.
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    • Furthermore, upon close examination of intermolecular vibrational couplings in neat liquid water and ice, another flaw of the prevalent electrostatic model was unravelled: (point) dipole-dipole couplings between vibrational modes of nearest neighbour water molecules are very small as the relative orientation between localized molecular transition dipoles (∼71 in tetrahedral H-bonded networks) approaches the magic angle
    • Furthermore, upon close examination of intermolecular vibrational couplings in neat liquid water and ice, another flaw of the prevalent electrostatic model was unravelled: (point) dipole-dipole couplings between vibrational modes of nearest neighbour water molecules are very small as the relative orientation between localized molecular transition dipoles (∼71 in tetrahedral H-bonded networks) approaches the magic angle.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.