{ "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" [ [ 2.841627 2.849258 1.50686 ] [ 0.998489 4.149663 3.105849 ] [ 4.765797 1.647113 1.498592 ] [ 3.299037 1.906995 3.475865 ] [ 3.256514 4.175642 3.223298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.841627e-10 2.849258e-10 1.50686e-10 ] [ 9.98489e-11 4.149663e-10 3.105849e-10 ] [ 4.765797e-10 1.647113e-10 1.498592e-10 ] [ 3.299037e-10 1.906995e-10 3.475865e-10 ] [ 3.256514e-10 4.175642e-10 3.223298000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1926218 0.0659173 -2.8883144 ] [ -2.3733433 0.7753298 0.3725153 ] [ 2.0835323 -1.2136432 -1.1373857 ] [ 0.0346961 -2.2025778 2.3646582 ] [ 1.4477367 2.5749738 1.2885266 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.910790765416413e-09 1.056111569662598e-10 -4.62758980519998e-09 ] [ -3.802515148392321e-09 1.24221527896954e-09 5.968353045502982e-10 ] [ 3.338186739741652e-09 -1.944470761032898e-09 -1.822292777372243e-09 ] [ 5.558928025293888e-11 -3.528918656653098e-09 3.78860008422301e-09 ] [ 2.319529893814143e-09 4.125562821532535e-09 2.064447193798913e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 9.0338212 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.44737771231274e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.8613368 2.9239275 -0.6349652 ] [ -0.8923696 4.6579949 3.7990071 ] [ 6.7130736 0.8442856 0.9096184 ] [ 2.9443369 0.58089 4.9369297 ] [ 4.5350863 5.7215729 3.799874 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.8613368e-10 2.9239275e-10 -6.349652000000001e-11 ] [ -8.923696e-11 4.657994900000001e-10 3.7990071e-10 ] [ 6.713073600000001e-10 8.442856e-11 9.096184e-11 ] [ 2.9443369e-10 5.8089e-11 4.936929700000001e-10 ] [ 4.5350863e-10 5.7215729e-10 3.799874e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0 0.0 -0.0 ] [ -0.0 0.0 0.0 ] [ 0.0 -0.0 0.0 ] [ -0.0 -0.0 0.0 ] [ 0.0 0.0 -0.0 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] [ 0.0 0.0 0.0 ] ] } "relaxed-potential-energy" { "source-value" 6.6613381e-16 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.067264016706429e-34 } }