{ "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" [ [ 8.267914 6.1007195 -46.2282754 ] [ -17.3989807 -19.7390975 42.8395851 ] [ -0.5294983 3.4472808 -66.2422235 ] [ 74.0669214 -14.8257265 39.4659743 ] [ -64.4063565 25.0168237 30.1649394 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.324665851358501e-08 9.774430152958666e-09 -7.406586206578377e-08 ] [ -2.787624010329042e-08 -3.162552053019173e-08 6.863658169199203e-08 ] [ -8.483497970133446e-10 5.523152703092722e-09 -1.061317418015083e-07 ] [ 1.186682898417112e-07 -2.375343238467501e-08 6.323146134055364e-08 ] [ -1.031903586152101e-07 4.008137005881535e-08 4.832956067452879e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 36.030613 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.772740578169256e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6050445 0.9666227 0.7757174 ] [ 0.3625267 0.4337628 3.0451101 ] [ 2.5282711 2.2789146 0.458658 ] [ 3.5990705 2.6421812 2.5115398 ] [ 1.2582361 2.5417775 2.5500837 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.050445e-11 9.666227e-11 7.757174e-11 ] [ 3.625267e-11 4.337628e-11 3.0451101e-10 ] [ 2.5282711e-10 2.2789146e-10 4.58658e-11 ] [ 3.5990705e-10 2.6421812e-10 2.5115398e-10 ] [ 1.2582361e-10 2.5417775e-10 2.5500837e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 0.0 0.0 ] [ 1e-07 2e-07 -2e-07 ] [ -1e-07 -2e-07 -1e-07 ] [ 0.0 1e-07 0.0 ] [ -1e-07 -0.0 3e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 0.0 0.0 ] [ 1.6021766208e-16 3.2043532416e-16 -3.2043532416e-16 ] [ -1.6021766208e-16 -3.2043532416e-16 -1.6021766208e-16 ] [ 0.0 1.6021766208e-16 0.0 ] [ -1.6021766208e-16 0.0 4.8065298624e-16 ] ] } "relaxed-potential-energy" { "source-value" -12.777902 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.047245584727356e-18 } }