{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 4.662164e-11 2.7774314e-10 1.2448468e-10 ] [ 2.100981e-10 1.3262649e-10 7.008072e-11 ] [ 2.7366586e-10 4.037665e-11 2.6551131e-10 ] ] "source-value" [ [ 0.4662164 2.7774314 1.2448468 ] [ 2.100981 1.3262649 0.7008072 ] [ 2.7366586 0.4037665 2.6551131 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.3346131251264e-13 -1.7319529270848e-13 2.8630896213696e-13 ] [ 2.4000605779584e-13 -2.2814995080192e-13 1.153567166976e-14 ] [ -3.7362758797056e-13 4.013452435104e-13 -2.9784463380672e-13 ] ] "source-value" [ [ 8.33e-05 -0.0001081 0.0001787 ] [ 0.0001498 -0.0001424 7.2e-06 ] [ -0.0002332 0.0002505 -0.0001859 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.793002904782304e-19 "source-value" -6.1123117 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.442930358405191e-09 -1.404564637043514e-09 2.676524164760544e-10 ] [ -1.664312875378514e-09 1.91711215327378e-09 -2.104772377167829e-09 ] [ 2.213825169733229e-10 -5.125475162302657e-10 1.837119800474112e-09 ] ] "source-value" [ [ 0.9006063 -0.8766603 0.1670555 ] [ -1.0387824 1.1965673 -1.3136956 ] [ 0.1381761 -0.319907 1.14664 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -9.463990648518176e-19 "source-value" -5.9069584 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.65014e-11 2.889022e-10 1.146995e-10 ] [ 2.106137e-10 1.301288e-10 8.224351e-11 ] [ 2.832705e-10 3.171528e-11 2.631337e-10 ] ] "source-value" [ [ 0.365014 2.889022 1.146995 ] [ 2.106137 1.301288 0.8224351 ] [ 2.832705 0.3171528 2.631337 ] ] } "instance-id" 1 }