{ "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" [ [ 0.148581 1.499098 2.912634 ] [ 0.4436014 1.560152 0.6683764 ] [ 2.110053 0.4783189 0.3653162 ] [ 2.063967 1.021193 2.434749 ] [ 2.249538 2.67297 1.348927 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.48581e-11 1.499098e-10 2.912634e-10 ] [ 4.436014e-11 1.560152e-10 6.683764e-11 ] [ 2.110053e-10 4.783189e-11 3.653162e-11 ] [ 2.063967e-10 1.021193e-10 2.434749e-10 ] [ 2.249538e-10 2.67297e-10 1.348927e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6915455 1.4774173 5.170517 ] [ -14.235362 4.0912302 -4.2378812 ] [ 9.1920643 -9.4087581 -9.1473999 ] [ 7.9454302 -10.3830235 12.843996 ] [ 5.789413 14.2231341 -4.6292319 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.392539111344785e-08 2.367083476727368e-09 8.284081523099777e-09 ] [ -2.280756437293151e-08 6.554873430755146e-09 -6.78983423630788e-09 ] [ 1.472731063968556e-08 -1.507449238277823e-08 -1.465575038163393e-08 ] [ 1.272998261351794e-08 -1.66354376419729e-08 2.057835027838946e-08 ] [ 9.27566223317584e-09 2.278797311726861e-08 -7.416847183547423e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.63216824 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.012845182884904e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.012475 1.5192864 2.9957767 ] [ 0.2588124 1.6361289 0.6064309 ] [ 2.2338681 0.3405342 0.2492496 ] [ 2.2178211 0.8704156 2.6008964 ] [ 2.3177138 2.8653668 1.277649 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.2475e-12 1.5192864e-10 2.9957767e-10 ] [ 2.588124e-11 1.6361289e-10 6.064309e-11 ] [ 2.2338681e-10 3.405342e-11 2.492496e-11 ] [ 2.2178211e-10 8.704156e-11 2.6008964e-10 ] [ 2.3177138e-10 2.8653668e-10 1.277649e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.7768295 -0.245764 0.2972492 ] [ -0.3828417 0.7777417 -0.3460452 ] [ 0.2066758 -0.8847303 -0.3383748 ] [ 0.9593284 -0.3511731 0.6911001 ] [ -0.006333 0.7039257 -0.3039294 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.244618073501903e-09 -3.93757338278376e-10 4.762457227151928e-10 ] [ -6.133800262608378e-10 1.246079579027438e-09 -5.544255337478568e-10 ] [ 3.311311375732571e-10 -1.41749421405181e-09 -5.421361980944231e-10 ] [ 1.537013546812605e-09 -5.626413353093453e-10 1.107264431975063e-09 ] [ -1.0146584623122e-11 1.127813308612094e-09 -4.869485830656395e-10 ] ] } "relaxed-potential-energy" { "source-value" -10.500866 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.682424214196504e-18 } }