forked from lijiext/lammps
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Makefile.lammps.gfortran | ||
Makefile.lammps.ifort | ||
README |
README
This directory contains build settings for the LATTE library which is required to use the LATTE package and its fix latte command in a LAMMPS input script. Information about the LATTE DFTB code can be found at ... The LATTE developement effort is led by Anders Niklasson, etc at LANLS. To download, build, and install LATTE as a library on your system, follow these steps. We are working on scripts that will automate this process. Go to this web site: https://??? and download a current tarball. The tarball you download is "latte-??.tgz", which can be unpacked in this directory or wherever you wish: tar xvfz latte*tgz Note that if you unpack and build LATTE in this directory, when you download a new LAMMPS tarball, the files you have added here will be lost. So you likely want to build it somewhere else. Build instructions for LATTE library ... When you have successully built the LATTE library, you can build LAMMPS with the LATTE package installed: $ cd lammps/src $ make yes-latte $ make g++ (or whatever target you wish) Note that the Makefile.lammps file in this directory is required to allow the LAMMPS build to find the necessary LATTE files. You should not normally need to edit this file.