move sources and examples for smatb styles to SMTBQ package folders

This commit is contained in:
Axel Kohlmeyer
2022-04-27 15:14:02 -04:00
parent 585b14f08f
commit 2d45e3340f
11 changed files with 4 additions and 16 deletions

4
src/.gitignore vendored
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@ -1537,6 +1537,10 @@
/pair_mgpt.h /pair_mgpt.h
/pair_morse_smooth_linear.cpp /pair_morse_smooth_linear.cpp
/pair_morse_smooth_linear.h /pair_morse_smooth_linear.h
/pair_smatb.cpp
/pair_smatb.h
/pair_smatb_single.cpp
/pair_smatb_single.h
/pair_smtbq.cpp /pair_smtbq.cpp
/pair_smtbq.h /pair_smtbq.h
/pair_vashishta*.cpp /pair_vashishta*.cpp

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@ -1,16 +0,0 @@
This package implements the Second Moment Tight Binding - QEq (SMTB-Q)
potential for the description of ionocovalent bonds in oxides.
Authors: Nicolas Salles, Emile Maras, Olivier Politano, Robert Tetot
at ICB, Universite de Bourgogne and ICMMO, Universite Paris-Sud.
Contact emails: lammps@u-bourgogne.fr, nsalles33@gmail.com
This package is occasionally maintained.
See the doc page for the pair_style smtbq command to get started.
There are potential files for this potential in the potentials dir.
There are example scripts for using this package in
examples/PACKAGES/smtbq.