Pentagon-pentagon correlations in water
Journal Article
·
· J. Phys. Chem.; (United States)
Computer simulation studies on the concentration of pentagonal rings of hydrogen-bonded water molecules (pentagons) and the spatial correlation of pentagons in liquid water are detailed. The pentagon-pentagon correlation function g/sub 55/(r) has a peak at r similarly ordered 3.2 A. The results support the idea that the anomalies of water may be related to the self-replicating propensity of pentagons in the random network. 24 references, 8 figures, 1 table.
- Research Organization:
- Boston Univ., MA
- OSTI ID:
- 5671225
- Journal Information:
- J. Phys. Chem.; (United States), Vol. 89:1
- Country of Publication:
- United States
- Language:
- English
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37 INORGANIC
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PHYSICAL AND ANALYTICAL CHEMISTRY
36 MATERIALS SCIENCE
WATER
MATHEMATICAL MODELS
COMPARATIVE EVALUATIONS
INTERMOLECULAR FORCES
TEMPERATURE DEPENDENCE
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THERMODYNAMIC PROPERTIES
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HYDROGEN COMPOUNDS
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NUMERICAL DATA
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ORGANIC
PHYSICAL AND ANALYTICAL CHEMISTRY
36 MATERIALS SCIENCE
WATER
MATHEMATICAL MODELS
COMPARATIVE EVALUATIONS
INTERMOLECULAR FORCES
TEMPERATURE DEPENDENCE
THEORETICAL DATA
THERMODYNAMIC PROPERTIES
DATA
HYDROGEN COMPOUNDS
INFORMATION
NUMERICAL DATA
OXYGEN COMPOUNDS
PHYSICAL PROPERTIES
400201* - Chemical & Physicochemical Properties
360402 - Polymers & Plastics- Structure & Phase Studies- (-1987)