Theoretical infrared absorption coefficient of OH groups in minerals

American Mineralogist

Volumn 93, Issue 5-6, 2008, Pages 950-953

  Balan, Etienne ^a,b   Refson, Keith ^c   Blanchard, Marc ^a,b   Delattre, Simon ^b   Lazzeri, Michele ^b   Ingrin, Jannick ^d   Mauri, Francesco ^b   Wright, Kate ^e   Winkler, Bjoern ^f  

^a INSTITUT DE RECHERCHE POUR LE DÉVELOPPEMENT   (France)

^b UNIVERSITÉ PIERRE ET MARIE CURIE   (France)

^c RUTHERFORD APPLETON LABORATORY   (United Kingdom)

^d UNIVERSITÉ DE TOULOUSE   (France)

^e CURTIN UNIVERSITY   (Australia)

^f GOETHE UNIVERSITY   (Germany)

Author keywords

DFT; Hydroxyl; Infrared; Spectroscopy

Indexed keywords

CHEMICAL BONDS; DENSITY FUNCTIONAL THEORY; HYDROGEN; INFRARED RADIATION; LIGHT ABSORPTION; SPECTROSCOPY;

ABSORPTION CO-EFFICIENT; BORN EFFECTIVE CHARGE; HYDROGEN DISTRIBUTION; HYDROXYL; MOLAR ABSORPTION COEFFICIENT; NOMINALLY ANHYDROUS MINERALS; STRETCHING MODES; THEORETICAL MODELING;

MINERALS;

ABSORPTION COEFFICIENT; EXPERIMENTAL MINERALOGY; HYDROUS MINERAL; HYDROXYL RADICAL; INFRARED SPECTROSCOPY; MEASUREMENT METHOD; OBSERVATIONAL METHOD;

EID: 46649093587     PISSN: 0003004X     EISSN: None     Source Type: Journal    
DOI: 10.2138/am.2008.2889     Document Type: Article

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