{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0880464 -1.2510451 0.6248925 ] [ -0.7601016 1.0535306 0.6007088 ] [ -2.7329854 0.5450023 -0.8367981 ] [ -0.5284826 0.6298105 -1.2145812 ] [ 0.0700002 -0.1803488 1.5260792 ] [ 1.3388262 0.5478746 -2.2190912 ] [ 0.6623255 0.5616344 0.8088573 ] [ 3.0384641 -1.9064584 0.7099326 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.743242518787817e-09 -2.004395227300193e-09 1.001188162261845e-09 ] [ -1.217817022986014e-09 1.687942110524e-09 9.624416031981792e-10 ] [ -4.378725348943143e-09 8.731899505362581e-10 -1.340698363195595e-09 ] [ -8.467224731955684e-10 1.009067666947857e-09 -1.945973618735681e-09 ] [ 1.121526848153268e-10 -2.889506333299392e-10 2.445048435873413e-09 ] [ 2.14503605462701e-09 8.777918824820963e-10 -3.55537606935502e-09 ] [ 1.061162440202367e-09 8.998375125306095e-10 1.295932266300328e-09 ] [ 4.868156184267839e-09 -3.054483102173026e-09 1.137437423434868e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.3051486015624789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.889019593211796e-20 } }