{ "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" [ [ 4.0805157 3.2299564 5.9692986 ] [ 0.8121182 4.7334777 -5.3962815 ] [ 5.960965 -4.4229161 1.7038114 ] [ 6.0153692 -3.2573423 -6.1580612 ] [ -7.9156855 5.4513301 4.7292025 ] [ -4.5310868 -5.9671131 5.9486504 ] [ -4.4221959 0.2326072 -6.7966202 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.537706855347348e-09 5.174960630283333e-09 9.563870659494172e-09 ] [ 1.301156793366178e-09 7.583867306018157e-09 -8.645796058555554e-09 ] [ 9.550518760407072e-09 -7.086292771179915e-09 2.729806791332517e-09 ] [ 9.637683897720401e-09 -5.2188376790029e-09 -9.866301684095594e-09 ] [ -1.268232624570556e-08 8.733993638483326e-09 7.577017680528912e-09 ] [ -7.259601337775485e-09 -9.560369102489413e-09 9.53078859619257e-09 ] [ -7.085138883577616e-09 3.726778176697497e-10 -1.088938598489702e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -32.663735 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.23330725650067e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2687492 2.4615873 1.8813084 ] [ 2.9898808 1.5350313 3.7488664 ] [ 1.4790335 4.5267475 1.9116843 ] [ 2.2021214 3.5952818 3.7822385 ] [ 4.4268698 2.1077487 2.1704752 ] [ 3.6418973 4.1691109 2.2007825 ] [ 4.3603729 3.2392455 4.0677207 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2687492e-10 2.4615873e-10 1.8813084e-10 ] [ 2.9898808e-10 1.5350313e-10 3.7488664e-10 ] [ 1.4790335e-10 4.5267475e-10 1.9116843e-10 ] [ 2.2021214e-10 3.5952818e-10 3.7822385e-10 ] [ 4.4268698e-10 2.1077487e-10 2.1704752e-10 ] [ 3.6418973e-10 4.1691109e-10 2.2007825e-10 ] [ 4.3603729e-10 3.2392455e-10 4.0677207e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001512 1.37e-05 -7.44e-05 ] [ 0.0001221 3.32e-05 -2e-06 ] [ 4.43e-05 -2.69e-05 1e-07 ] [ -4.5e-05 3.44e-05 4.35e-05 ] [ 5.62e-05 -6.72e-05 -9.1e-06 ] [ 1.83e-05 2.88e-05 -6.5e-06 ] [ -4.47e-05 -1.6e-05 4.84e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.4224910506496e-13 2.194981970496e-14 -1.1920194058752e-13 ] [ 1.9562576539968e-13 5.319226381056e-14 -3.2043532416e-15 ] [ 7.097642430144e-14 -4.309855109952001e-14 1.6021766208e-16 ] [ -7.209794793600001e-14 5.511487575552001e-14 6.969468300480001e-14 ] [ 9.004232608896e-14 -1.0766626891776e-13 -1.457980724928e-14 ] [ 2.931983216064e-14 4.614268667904e-14 -1.04141480352e-14 ] [ -7.161729494976001e-14 -2.56348259328e-14 7.754534844671999e-14 ] ] } "relaxed-potential-energy" { "source-value" -50.517683 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.093825063958561e-18 } }