{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9541135 0.9980995 1.487518 ] [ 0.5060444 0.4713921 2.728449 ] [ 2.547937 2.415228 0.679434 ] [ 2.841188 2.325305 2.080908 ] [ 1.503866 2.653234 2.3648 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.541135e-11 9.980995000000001e-11 1.487518e-10 ] [ 5.060444e-11 4.713921e-11 2.728449e-10 ] [ 2.547937e-10 2.415228e-10 6.79434e-11 ] [ 2.841188e-10 2.325305e-10 2.080908e-10 ] [ 1.503866e-10 2.653234e-10 2.3648e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.6456193 -3.7531311 -56.3439542 ] [ -22.9694489 -28.0748128 51.6713942 ] [ 2.057645 7.8998084 -67.911232 ] [ 82.160633 -9.6596537 43.210218 ] [ -59.6032098 33.5877892 29.3735741 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.636572769197262e-09 -6.013178903217387e-09 -9.027296614266597e-08 ] [ -3.680111402024028e-08 -4.498080870149658e-08 8.278669975138072e-08 ] [ 3.296710712906016e-09 1.265688832727945e-08 -1.088057882001248e-07 ] [ 1.31635845342729e-07 -1.547647132316422e-08 6.923040105927133e-08 ] [ -9.549486926619745e-08 5.381357060059874e-08 4.70616536923564e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 54.948849 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.803776120766947e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.8444626 0.5460442 0.5208906 ] [ 0.0887162 0.8933364 2.7207728 ] [ 2.7421585 1.893591 0.1831002 ] [ 3.1592172 3.0737944 2.1741867 ] [ 1.5185944 2.4564926 3.7421587 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.444626e-11 5.460442e-11 5.208906e-11 ] [ 8.87162e-12 8.933364000000001e-11 2.7207728e-10 ] [ 2.7421585e-10 1.893591e-10 1.831002e-11 ] [ 3.1592172e-10 3.0737944e-10 2.1741867e-10 ] [ 1.5185944e-10 2.4564926e-10 3.7421587e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.92e-05 -3.17e-05 1.14e-05 ] [ 1.11e-05 3.97e-05 -4.73e-05 ] [ 2.81e-05 8.7e-06 7e-06 ] [ -4.55e-05 1e-07 -2.85e-05 ] [ 2.55e-05 -1.68e-05 5.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.076179111936e-14 -5.078899887936e-14 1.826481347712e-14 ] [ 1.778416049088e-14 6.360641184576e-14 -7.578295416384e-14 ] [ 4.502116304448e-14 1.393893660096e-14 1.12152363456e-14 ] [ -7.28990362464e-14 1.6021766208e-16 -4.56620336928e-14 ] [ 4.08555038304e-14 -2.691656722944e-14 9.180472037184001e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.837104 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.736295466597816e-18 } }