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parsplice

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Parallel Trajectory Splicing AMD Code

Installation

To install this package, run one of the following:

Conda
$conda install conda-forge::parsplice

Usage Tracking

1.1.2.dev0
1 / 8 versions selected
Downloads (Last 6 months): 0

Description

The ParSplice code implements the Parallel Trajectory Splicing algorithm described in [1]. This method is part of the Accelerated Molecular Dynamics family of techniques developed in Los Alamos National Laboratory over the last 16 years. These methods aim at generating high-quality trajectories of ensembles of atoms in materials.

About

Summary

Parallel Trajectory Splicing AMD Code

Last Updated

Jan 26, 2020 at 21:00

License

BSD-3-Clause

Total Downloads

68.5K

Supported Platforms

linux-64