{ "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" [ 5.41394 0 0 ] "si-unit" "m" "si-value" [ 5.413940000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0321649 5.43167 0 ] "si-unit" "m" "si-value" [ 3.216490000000001e-12 5.431670000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.034689 -0.0250046 5.52467 ] "si-unit" "m" "si-value" [ -3.4689e-12 -2.50046e-12 5.52467e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0104706 0.0216981 0.0176006 ] [ 1.39448 1.38403 1.49781 ] [ 0.0179868 2.6904 2.7801 ] [ 1.33759 4.02716 4.17727 ] [ 2.6683 -0.0231463 2.83015 ] [ 4.02805 1.42643 4.22871 ] [ 2.71964 2.8128 -0.0574889 ] [ 4.09713 4.0529 1.34951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04706e-12 2.16981e-12 1.76006e-12 ] [ 1.39448e-10 1.38403e-10 1.49781e-10 ] [ 1.79868e-12 2.6904e-10 2.7801e-10 ] [ 1.33759e-10 4.02716e-10 4.17727e-10 ] [ 2.6683e-10 -2.31463e-12 2.83015e-10 ] [ 4.02805e-10 1.42643e-10 4.228710000000001e-10 ] [ 2.71964e-10 2.8128e-10 -5.74889e-12 ] [ 4.09713e-10 4.052900000000001e-10 1.34951e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5257897 0.2850365 0.3496683 ] [ 0.1030372 -0.1077264 -1.3641226 ] [ -0.5875691 0.2591652 0.2255551 ] [ -0.539223 0.9117857 -0.6255522 ] [ 0.7436527 -0.1228057 0.07125 ] [ 0.1493828 -0.7775234 -0.9124656 ] [ -0.1515161 -0.8712414 1.5424758 ] [ -0.2435543 0.4233094 0.7131913 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.424079717378697e-10 4.56678820137141e-10 5.602303799105021e-10 ] [ 1.650837942727848e-10 -1.725967209449376e-10 -2.185565355631328e-09 ] [ -9.413894828804093e-10 4.152284277859367e-10 3.613791108995334e-10 ] [ -8.63930491115382e-10 1.460841743755334e-09 -1.002245118187295e-09 ] [ 1.191462979751012e-09 -1.967564230620138e-10 1.141550851725e-10 ] [ 2.393376316814952e-10 -1.245729823868236e-09 -1.46193106364879e-09 ] [ -2.427555550948074e-10 -1.395882613653447e-09 2.471318685270457e-09 ] [ -3.902170085702262e-10 6.782164296325596e-10 1.142658436432084e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -25.556376074190158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.094582859578412e-18 } }