Understanding thermodynamic properties at the molecular level: Multiple temperature charge density study of ribitol and xylitol

Journal of Physical Chemistry A

Volumn 115, Issue 26, 2011, Pages 7794-7804

  Madsen, Anders Østergaard ^a   Mattson, Rikke ^a   Larsen, Sine ^a  

^a UNIVERSITY OF COPENHAGEN   (Denmark)

Author keywords

[No Author keywords available]

Indexed keywords

ATOMIC DISPLACEMENT PARAMETERS; ELECTRON DENSITIES; EPIMERS; HARMONIC OSCILLATORS; HIGH QUALITY; HIGH RESOLUTION; HYDROGEN BOND INTERACTION; INTERMOLECULAR INTERACTIONS; INTRAMOLECULAR INTERACTIONS; MEAN SQUARE DEVIATION; MOLECULAR LEVELS; MULTIPOLE REFINEMENTS; NORMAL COORDINATE ANALYSIS; PENTITOLS; PERIODIC DFT CALCULATION; PHYSICOCHEMICAL PROPERTY; RIGID BODY; STATISTICAL APPROACH; SUBLIMATION ENERGY; TEMPERATURE RANGE; THERMAL MOTION; THERMODYNAMIC MEASUREMENTS; TOPOLOGICAL ANALYSIS; VIBRATIONAL MODELS; X-RAY DIFFRACTION DATA;

CARRIER CONCENTRATION; CRYSTALS; DIFFRACTION; ELECTRON DENSITY MEASUREMENT; ENTROPY; HYDROGEN; HYDROGEN BONDS; SUGAR SUBSTITUTES; X RAY DIFFRACTION; X RAY DIFFRACTION ANALYSIS;

TEMPERATURE;

EID: 79959786840     PISSN: 10895639     EISSN: 15205215     Source Type: Journal    
DOI: 10.1021/jp202411n     Document Type: Article

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