{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.327038 2.33879 1.333944 ] [ 3.095823 1.457233 3.921802 ] [ 1.16952 4.791902 2.053879 ] [ 1.997895 3.950607 4.032131 ] [ 4.742513 1.791132 2.167365 ] [ 3.563011 4.139404 2.001972 ] [ 4.473125 3.165685 4.251983 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.327038e-10 2.33879e-10 1.333944e-10 ] [ 3.095823e-10 1.457233e-10 3.921802e-10 ] [ 1.16952e-10 4.791902e-10 2.053879e-10 ] [ 1.997895e-10 3.950607e-10 4.032131e-10 ] [ 4.742513e-10 1.791132e-10 2.167365e-10 ] [ 3.563011e-10 4.139404e-10 2.001972e-10 ] [ 4.473124999999999e-10 3.165685e-10 4.251983e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1702112 -0.7158596 0.2914755 ] [ -1.4267846 -0.9105794 -0.7965225 ] [ 0.7015074 -0.6753029 -0.1755225 ] [ 0.5628103 -0.6732435 0.330263 ] [ -0.9518525 0.5261675 0.3732169 ] [ 0.5074513 0.9517024 0.2086593 ] [ 0.7770792 1.4971154 -0.2315698 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.72708405238313e-10 -1.14693351489524e-09 4.669952316359904e-10 ] [ -2.28596092903748e-09 -1.458909026062092e-09 -1.276169727441168e-09 ] [ 1.123938755598194e-09 -1.08195451833844e-09 -2.81218045924368e-10 ] [ 9.017215046054342e-10 -1.078654995805565e-09 5.291396573152704e-10 ] [ -1.525035821950032e-09 8.430132671247839e-10 5.979593916674516e-10 ] [ 8.130266090545671e-10 1.52479533523925e-09 3.343090521724934e-10 ] [ 1.245018126749967e-09 2.39864329251964e-09 -3.710157196433319e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -6.921162158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.108892419980158e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2579392 2.2460232 1.5086761 ] [ 2.793447 1.5238149 3.7645026 ] [ 1.3663063 4.428602 1.9521739 ] [ 2.1650457 3.8398292 4.1363686 ] [ 4.5685328 2.0087203 2.1132373 ] [ 3.7224467 4.3209817 2.1007389 ] [ 4.4952073 3.2667816 4.1873786 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2579392e-10 2.2460232e-10 1.5086761e-10 ] [ 2.793447e-10 1.5238149e-10 3.7645026e-10 ] [ 1.3663063e-10 4.428602e-10 1.9521739e-10 ] [ 2.1650457e-10 3.8398292e-10 4.1363686e-10 ] [ 4.5685328e-10 2.0087203e-10 2.1132373e-10 ] [ 3.7224467e-10 4.3209817e-10 2.1007389e-10 ] [ 4.4952073e-10 3.2667816e-10 4.1873786e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 1e-07 3.6e-06 ] [ 2e-07 -4.9e-06 -4.2e-06 ] [ 4.8e-06 -3.6e-06 -4e-06 ] [ -8.4e-06 6.8e-06 5.3e-06 ] [ -9.5e-06 7.6e-06 -3e-06 ] [ -1e-07 -5.7e-06 -2e-07 ] [ 9.2e-06 -4e-07 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 1.6021766208e-16 5.76783583488e-15 ] [ 3.2043532416e-16 -7.850665441919999e-15 -6.72914180736e-15 ] [ 7.69044777984e-15 -5.76783583488e-15 -6.4087064832e-15 ] [ -1.345828361472e-14 1.089480102144e-14 8.491536090240001e-15 ] [ -1.52206778976e-14 1.217654231808e-14 -4.8065298624e-15 ] [ -1.6021766208e-16 -9.13240673856e-15 -3.2043532416e-16 ] [ 1.474002491136e-14 -6.408706483200001e-16 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }