{ "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" [ [ 1.250049 0.006506 1.072993 ] [ 1.196915 2.832702 0.8072165 ] [ 0.1797786 2.271145 2.71237 ] [ 2.446401 0.6534775 0.0239044 ] [ 1.500106 1.367345 2.855106 ] [ 2.614126 2.99563 2.902741 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.250049e-10 6.506e-13 1.072993e-10 ] [ 1.196915e-10 2.832702e-10 8.072165e-11 ] [ 1.797786e-11 2.271145e-10 2.71237e-10 ] [ 2.446401e-10 6.534775e-11 2.39044e-12 ] [ 1.500106e-10 1.367345e-10 2.855106e-10 ] [ 2.614126e-10 2.99563e-10 2.902741e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -27.2445228 -22.609295 16.8475061 ] [ 0.142031 7.0119948 -9.8126134 ] [ -52.0654335 28.9751492 -3.4709851 ] [ 25.8654534 15.4435182 -23.2188862 ] [ 38.3464714 -43.3900829 18.036963 ] [ 14.9560006 14.5687157 1.6180156 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.365053747501255e-08 -3.622408386177034e-08 2.699268039220539e-08 ] [ 2.275587476288448e-10 1.123445413373117e-08 -1.57215397784288e-08 ] [ -8.341802030551711e-08 4.642330663243183e-08 -5.56113117836515e-09 ] [ 4.144102472387187e-08 2.47432438029393e-08 -3.720075663065575e-08 ] [ 6.143781996725584e-08 -6.951857639695388e-08 2.889840042883463e-08 ] [ 2.396215450199077e-08 2.334165568962191e-08 2.592346766409685e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 22.746121 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.644330328008792e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.0049316 -0.1348916 1.4355762 ] [ 1.2001526 3.357542 0.8415378 ] [ -0.330754 1.9092233 2.14055 ] [ 2.5358693 1.3134299 0.1366098 ] [ 1.6231393 1.1165737 3.5595159 ] [ 3.1540368 2.5649282 2.2605412 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.0049316e-10 -1.348916e-11 1.4355762e-10 ] [ 1.2001526e-10 3.357542e-10 8.415378e-11 ] [ -3.30754e-11 1.9092233e-10 2.14055e-10 ] [ 2.5358693e-10 1.3134299e-10 1.366098e-11 ] [ 1.6231393e-10 1.1165737e-10 3.5595159e-10 ] [ 3.1540368e-10 2.5649282e-10 2.2605412e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.04e-05 -8.7e-06 5.34e-05 ] [ 3.84e-05 -1.61e-05 5.62e-05 ] [ 3.65e-05 -1.71e-05 -3.99e-05 ] [ -3.66e-05 5e-05 2.22e-05 ] [ -5.02e-05 5.6e-06 -2.36e-05 ] [ -8.4e-06 -1.38e-05 -6.83e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.268440306432e-14 -1.393893660096e-14 8.555623155072e-14 ] [ 6.152358223872e-14 -2.579504359488e-14 9.004232608896e-14 ] [ 5.84794466592e-14 -2.739722021568e-14 -6.392684716992e-14 ] [ -5.863966432128e-14 8.010883104e-14 3.556832098176e-14 ] [ -8.042926636416e-14 8.972189076479999e-15 -3.781136825088e-14 ] [ -1.345828361472e-14 -2.211003736704e-14 -1.0942866320064e-13 ] ] } "relaxed-potential-energy" { "source-value" -16.599118 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.659471878550046e-18 } }