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Building a reusable LAMPS script library Craig M. Tenney University of Note Dame February 2010overviewMotivation Evolving simulation strategies Implementation details Examples Closing motivation Something
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Building a reusable LAMMPS involves creating a customized reusable template for performing molecular dynamics simulations using the LAMMPS software.
Researchers, scientists, or engineers who use LAMMPS for their simulations may be required to create and use reusable templates for efficiency and consistency.
To fill out building a reusable LAMMPS template, one must define the specific parameters, settings, and input files required for their simulation needs.
The purpose of building a reusable LAMMPS template is to save time, ensure consistency in simulations, and facilitate collaboration by providing a standardized approach for performing molecular dynamics simulations.
Information such as simulation parameters, force field settings, molecule structures, boundary conditions, and output options must be included in a reusable LAMMPS template.
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