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ARTICLE INFORMATION

Document Number:  E-JCPSA6-124-507623    21  July-Issue #3

Journal:  J. Chem.Phys. 125, 034904 (2006)

All Authors: Hideaki Shirota and Edward W. Castner

Title:  Molecular dynamics and interactions in aqueous and
dichloromethane solutions of polyvinylpyrolidone

DEPOSIT INFORMATION

Description:  
Molecular Dynamics and Interactions of Aqueous and Dichloromethane Solutions of Polyvinylpyrrolidone.", by H. Shirota and E. W. Castner, Jr.

This EPAPS file contains the results from DFT calculations for H2O, CH2Cl2, 
and EP are also tabulated, including atomic coordinates (Table A), 
calculated normal mode frequencies of CH2Cl2 and EP compared with observed 
intramolecular vibrational frequencies of CH2Cl2 and EP Kerr spectra (Table B),
and static polarizability tensor elements (Table C).  
The full author list of Ref. 50 is also listed.

No. of Files:  2
FileNames: README.TXT and 507623jcp_EPAPS.pdf

FileTypes:  Ascii and pdf

Contact Information

Edward W. Castner
Dep[t. of Chemistry
Rutgers University
610 Taylor Road
Piscataway, NJ  08854
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