{ "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" [ [ 0.1139215 0.7675217 1.173379 ] [ 0.3197986 0.4128002 2.663942 ] [ 1.547269 0.0076724 0.5415715 ] [ 1.777725 2.329132 1.457723 ] [ 2.606996 1.505358 2.342036 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.139215e-11 7.675217e-11 1.173379e-10 ] [ 3.197986e-11 4.128002e-11 2.663942e-10 ] [ 1.547269e-10 7.672400000000001e-13 5.415715e-11 ] [ 1.777725e-10 2.329132e-10 1.457723e-10 ] [ 2.606996e-10 1.505358e-10 2.342036e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.1418269 6.1125442 -15.604801 ] [ -4.9215639 -7.5443778 25.8908933 ] [ 13.3335554 -13.4059689 -14.2572099 ] [ -4.5377895 21.9669691 -11.4595291 ] [ 18.2676249 -7.1291666 15.4306467 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.547511740098055e-08 9.79337541084664e-09 -2.500164733443646e-08 ] [ -7.88521461835327e-09 -1.208742572964254e-08 4.148178393688736e-08 ] [ 2.136271073402159e-08 -2.14787299507519e-08 -2.284256837961831e-08 ] [ -7.270340247011722e-09 3.519496432185602e-08 -1.836018960939726e-08 ] [ 2.926796153232394e-08 -1.142218405230823e-08 2.472262138656467e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 10.579022 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.694946171932886e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.3952719 1.2368609 1.0353008 ] [ 0.5726554 -0.014919 2.9273261 ] [ 1.8617788 -0.0630383 0.6283004 ] [ 1.6793096 2.5576833 0.8478513 ] [ 2.6472382 1.3058974 2.739873 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -3.952719e-11 1.2368609e-10 1.0353008e-10 ] [ 5.726554e-11 -1.4919e-12 2.9273261e-10 ] [ 1.8617788e-10 -6.303830000000001e-12 6.283004e-11 ] [ 1.6793096e-10 2.5576833e-10 8.478513e-11 ] [ 2.6472382e-10 1.3058974e-10 2.739873e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3e-07 0.0 -3.7e-06 ] [ -7.1e-06 -1.01e-05 3.7e-06 ] [ -3.4e-06 1.14e-05 6.3e-06 ] [ 2.9e-06 -5.9e-06 -1.2e-06 ] [ 7.3e-06 4.6e-06 -5.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.8065298624e-16 0.0 -5.928053496960001e-15 ] [ -1.137545400768e-14 -1.618198387008e-14 5.928053496960001e-15 ] [ -5.44740051072e-15 1.826481347712e-14 1.009371271104e-14 ] [ 4.646312200320001e-15 -9.45284206272e-15 -1.92261194496e-15 ] [ 1.169588933184e-14 7.370012455680001e-15 -8.17110076608e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.901027 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.906754722290956e-18 } }