3D_Ordering_simulations.zip
3D_Ordering_simulations
README.md
1.9 kB
post-processing
.mkhisto.sh.swp
12.3 kB
README.md
639 Bytes
scripts
mkhisto.sh
2.6 kB
z_as.dat
25.9 kB
z_ga.dat
25.9 kB
z_gaas_coarse.dat
25.9 kB
z_gaas_fine.dat
25.9 kB
production-MD
MTS
QE
GaAs.in
16.8 kB
data.lmp
14.2 kB
in.lmp
5.1 kB
init.xyz
16.3 kB
input.xml
2.4 kB
README.md
1.2 kB
WZ
data.lmp
14.2 kB
in.lmp
5.1 kB
init.xyz
14.6 kB
input.xml
2.0 kB
ZB
data.lmp
14.2 kB
in.lmp
5.1 kB
init.xyz
14.6 kB
input.xml
2.0 kB
potential
input.nn
31.1 kB
scaling.data
8.4 kB
weights.031.data
119.6 kB
weights.033.data
119.6 kB
visualization
README.md
256 Bytes
WZ
WZ_A_110_bonds.png
399.3 kB
WZ_A_111_bonds.png
792.6 kB
WZ_A_112_bonds.png
341.2 kB
WZ_B_110_bonds.png
417.3 kB
WZ_B_111_bonds.png
761.0 kB
WZ_B_112_bonds.png
253.0 kB
densities
As_density_A.dens
16.2 MB
As_density_B.dens
16.2 MB
Ga_density_A.dens
16.2 MB
Ga_density_B.dens
16.2 MB
gaas_wz.xyz
10.5 kB
vmd_visualization
3dplot_a_110.vmd
28.2 kB
3dplot_a_111.vmd
28.2 kB
3dplot_a_112.vmd
28.3 kB
3dplot_b_110.vmd
28.3 kB
3dplot_b_111.vmd
28.3 kB
3dplot_b_112.vmd
28.3 kB
ZB
ZB_A_110_bonds.png
415.0 kB
ZB_A_111_bonds.png
982.0 kB
ZB_A_112_bonds.png
306.6 kB
ZB_B_110_bonds.png
352.2 kB
ZB_B_111_bonds.png
1.0 MB
ZB_B_112_bonds.png
330.5 kB
densities
As_density_A.dens
16.2 MB
As_density_B.dens
16.2 MB
Ga_density_A.dens
16.2 MB
Ga_density_B.dens
16.2 MB
gaas_zb.xyz
10.5 kB
vmd_visualization
3dplot_a_bonds_110.vmd
28.1 kB
3dplot_a_bonds_111.vmd
27.9 kB
3dplot_a_bonds_112.vmd
28.1 kB
3dplot_a_bonds_oblique.vmd
28.2 kB
3dplot_b_bonds_110.vmd
28.2 kB
3dplot_b_bonds_111.vmd
28.1 kB
3dplot_b_bonds_112.vmd
28.1 kB
3dplot_b_bonds_oblique.vmd
28.2 kB