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Research data and source code supporting "Non-equilibrium simulations of thermally induced electric fields in water"

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DataCite Commons2021-04-24 更新2024-08-25 收录
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https://www.repository.cam.ac.uk/handle/1810/256177
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资源简介:
The archive contains a LAMMPS input script, equilibrated structures, and C++ source files to reproduce the temperature and density profiles shown in the publication, as well as the discrete NEMD trajectory for further post-processing. The updated C++ source files can be compiled with LAMMPS (9Dec14), which is freely available for download on the LAMMPS homepage. Detailed download and installation instructions for LINUX can be found in the INSTALL file. The archive also contains a README file with a brief summary. Information on copyrights can be found in the file COPYING. This record is licensed under a GNU GPLv3 licence.
提供机构:
Apollo - University of Cambridge Repository
创建时间:
2016-06-06
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