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Scope of Chapter
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THE DL_POLY_2 USER MANUAL
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The STATIS File
Contents
Index
DL_MULTI Data Files
Subsections
Scope of Chapter
The INPUT files
The CONTROL File
The CONFIG File
The FIELD File
Format
Definitions of Variables
General information
Molecular details
.
molecules
n
molecular types
n
.
Non-bonded Interactions
The OUTPUT Files
The OUTPUT File
Header
Simulation Control Specifications
Force Field Specification
Summary of the Initial Configuration
Simulation Progress
Remaining subsections
W Smith 2003-05-12
