{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.982478 1.406412 2.920232 ] [ 1.664708 2.759694 5.087468 ] [ 1.282886 3.129979 1.519732 ] [ 2.3658 4.253432 3.372825 ] [ 3.481612 3.001234 2.026348 ] [ 4.008994 2.747584 4.108071 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.982478e-10 1.406412e-10 2.920232e-10 ] [ 1.664708e-10 2.759694e-10 5.087468e-10 ] [ 1.282886e-10 3.129979e-10 1.519732e-10 ] [ 2.3658e-10 4.253432e-10 3.372825e-10 ] [ 3.481612e-10 3.001234e-10 2.026348e-10 ] [ 4.008994e-10 2.747584e-10 4.108071e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0270986 -1.3639822 0.8318757 ] [ 0.8183319 -0.5175115 -0.9811235 ] [ -1.0203976 -0.0327571 -0.2286197 ] [ -2.5457898 4.2063573 2.6597437 ] [ 3.1516372 -1.5326768 -5.8905858 ] [ 0.623317 -0.7594296 3.6087095 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.645593364176411e-09 -2.18534039202735e-09 1.332811797951634e-09 ] [ 1.311112238234844e-09 -8.291448262951392e-10 -1.571933133817469e-09 ] [ -1.63485717864043e-09 -5.248265978520768e-11 -3.662891383943098e-10 ] [ -4.078804899031108e-09 6.739327324791411e-09 4.261379173460089e-09 ] [ 5.049479439083574e-09 -2.455618936202557e-09 -9.437758851576464e-09 ] [ 9.986639247471935e-10 -1.216740350263496e-09 5.781789992158857e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.09139127908194 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.157308074690092e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.3337153 1.1849427 2.9658548 ] [ 1.4158717 2.7988745 4.5277412 ] [ 1.1128107 3.1125665 2.1410166 ] [ 2.5951104 4.581169 3.3790372 ] [ 3.5129546 2.9672375 1.8171511 ] [ 3.8160155 2.6535448 4.2038752 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3337153e-10 1.1849427e-10 2.9658548e-10 ] [ 1.4158717e-10 2.7988745e-10 4.5277412e-10 ] [ 1.1128107e-10 3.1125665e-10 2.1410166e-10 ] [ 2.5951104e-10 4.581169e-10 3.3790372e-10 ] [ 3.5129546e-10 2.9672375e-10 1.8171511e-10 ] [ 3.8160155e-10 2.6535448e-10 4.2038752e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1e-07 -5e-07 6e-07 ] [ -5e-07 -1.3e-06 -1.8e-06 ] [ 9e-07 3e-07 2.2e-06 ] [ 1.4e-06 3e-07 -6e-07 ] [ -6e-07 2e-07 9e-07 ] [ -1.3e-06 1.1e-06 -1.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.6021766208e-16 -8.010883104e-16 9.6130597248e-16 ] [ -8.010883104e-16 -2.08282960704e-15 -2.88391791744e-15 ] [ 1.44195895872e-15 4.8065298624e-16 3.52478856576e-15 ] [ 2.24304726912e-15 4.8065298624e-16 -9.6130597248e-16 ] [ -9.6130597248e-16 3.2043532416e-16 1.44195895872e-15 ] [ -2.08282960704e-15 1.76239428288e-15 -1.92261194496e-15 ] ] } "relaxed-potential-energy" { "source-value" -6.737433279081937 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.079455808394496e-18 } }