{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.4238 0 0 ] "si-unit" "m" "si-value" [ 5.4238e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0012341 5.50722 0 ] "si-unit" "m" "si-value" [ -1.2341e-13 5.507220000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.00966142 -0.113973 5.43239 ] "si-unit" "m" "si-value" [ -9.661420000000001e-13 -1.13973e-11 5.43239e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0339885 -0.0385369 0.0299316 ] [ 1.35039 1.32575 1.36375 ] [ -0.105411 2.62445 2.64243 ] [ 1.34087 3.97443 4.1654 ] [ 2.65221 0.0889868 2.75972 ] [ 4.05512 1.26127 4.10909 ] [ 2.71709 2.70534 0.0564386 ] [ 4.05687 4.02913 1.37335 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.39885e-12 -3.85369e-12 2.99316e-12 ] [ 1.35039e-10 1.32575e-10 1.36375e-10 ] [ -1.05411e-11 2.62445e-10 2.64243e-10 ] [ 1.34087e-10 3.97443e-10 4.1654e-10 ] [ 2.652210000000001e-10 8.89868e-12 2.75972e-10 ] [ 4.05512e-10 1.26127e-10 4.10909e-10 ] [ 2.71709e-10 2.70534e-10 5.64386e-12 ] [ 4.05687e-10 4.02913e-10 1.37335e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.1395443 -0.2229085 0.0778267 ] [ -0.508866 0.3110813 -0.2804696 ] [ 1.1309695 0.2481842 1.3942426 ] [ -0.2104915 0.4268485 -1.2416601 ] [ 0.2310432 -2.5091896 0.0531958 ] [ 0.1275998 0.4508515 0.0694426 ] [ -0.2404474 -0.0482572 -0.3234164 ] [ -0.6693518 1.3433898 0.2508383 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.235746150259015e-10 -3.571387872775968e-10 1.246921192140154e-10 ] [ -8.152932083200128e-10 4.98407186028071e-10 -4.493618359651277e-10 ] [ 1.812012891737866e-09 3.976349228919514e-10 2.233822897443406e-09 ] [ -3.372445601771232e-10 6.838866873235488e-10 -1.98935878320019e-09 ] [ 3.701720134348186e-10 -4.020164914274504e-09 8.522906708475264e-11 ] [ 2.044374163787559e-10 7.223437327526112e-10 1.112593102075661e-10 ] [ -3.85239202812146e-10 -7.731655762526976e-11 -5.181701948633012e-10 ] [ -1.072419805050398e-09 2.152347730181188e-09 4.018872598612167e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -27.279264 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.37061990134311e-18 } }