· Thank you for your efficient reply. I can load the dump file, but my problem now is I cannot load the lammps data file as shown in the attached photo It seems from the linked manual I have to load the data file first before merging with the dump file. · Description: The dump tool reads one or more LAMMPS dump files, stores their contents as a series of snapshots with 2d arrays of atom attributes, and allows the values to be accessed and manipulated. The LAMMPS dump and the XYZ file formats can store multiple simulation timesteps in one file. · LAMMPS is a classical molecular dynamics code with a focus on materials modeling. It's an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. LAMMPS has potentials for solid-state materials (metals, semiconductors) and soft matter (biomolecules, polymers) and coarse-grained or mesoscopic www.doorway.rug: dump.
The manual is organized in three parts: 1) the User Guide for how to install and use LAMMPS, 2) the Programmer Guide for how to write programs using the LAMMPS library from different programming languages and how to modify and extend LAMMPS, and 3) the Command Reference which includes detailed descriptions of all commands included in the LAMMPS code. LAMMPS is a classical molecular dynamics code with a focus on materials modeling. It's an acronym for Large-scale Atomic/Molecular Massively Parallel Simulator. LAMMPS has potentials for solid-state materials (metals, semiconductors) and soft matter (biomolecules, polymers) and coarse-grained or mesoscopic systems. You should know that LAMMPS can produce dump files containing the atom positions. This can be achieved with the "dump" command in the LAMMPS input script. For instance, to generate atomic data files in Atomeye CFG format, the "dump" command can be paired with the "dump_modify" command so that atom elements are properly written.
LAMMPS Users Manual Table of Contents LAMMPS Documentation. Output from LAMMPS (thermo, dumps, computes, fixes, variables). Manual modifications. Now, we'll dump the same system but change natypes, units, and atom_style parameters. [9]. Dump Now. Based on the current settings, generate a topology file. Note. If you want to edit the force field information with a text editor and customize it.
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