Development of software to scan the nonbonded intermolecular interactions

Anjana, Jain and Vijayan, Kalyani (1995) Development of software to scan the nonbonded intermolecular interactions. Technical Report. National Aerospace Laboratories, Bangalore, India.

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    Abstract

    A computer program in language IC I has been developed to scan the intermolecular contact distances in any known crystal structure. The program can be used with a PC/AT 38613; system having a DOS operating system. It has also been tested using a workstation having the UNIX operating system. The program has been tested on a known crystal structure.

    Item Type: Proj.Doc/Technical Report (Technical Report)
    Uncontrolled Keywords: Nonbonded intermolecular interactions;'C';Kevlar
    Subjects: MATHEMATICAL AND COMPUTER SCIENCES > Computer Programming and Software
    Division/Department: Materials Science Division, Materials Science Division
    Depositing User: M/S ICAST NAL
    Date Deposited: 23 Oct 2006
    Last Modified: 24 May 2010 09:52
    URI: http://nal-ir.nal.res.in/id/eprint/3154

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