{ "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" [ [ 1.152391 0.2084818 1.476287 ] [ 0.2004725 1.985654 1.37487 ] [ 0.8976264 2.29727 2.845471 ] [ 1.752289 1.001076 2.997864 ] [ 1.785348 1.533822 0.3428561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.152391e-10 2.084818e-11 1.476287e-10 ] [ 2.004725e-11 1.985654e-10 1.37487e-10 ] [ 8.976264000000001e-11 2.29727e-10 2.845471e-10 ] [ 1.752289e-10 1.001076e-10 2.997864e-10 ] [ 1.785348e-10 1.533822e-10 3.428561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.0997887 -30.2775131 -6.198743 ] [ -30.5453736 4.8456656 -26.585337 ] [ -14.7220488 51.3459822 33.544699 ] [ 35.0359175 -34.0356634 24.3932009 ] [ 18.3312935 8.1215286 -25.1538199 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.297729219547723e-08 -4.85099240244489e-08 -9.931481194771061e-09 ] [ -4.893908385872046e-08 7.76361220049759e-09 -4.259440574841565e-08 ] [ -2.358732259196773e-08 8.226533293061991e-08 5.374453293236316e-08 ] [ 5.613372836925169e-08 -5.453114462216899e-08 3.908221651044776e-08 ] [ 2.936997011669608e-08 1.301212335528273e-08 -4.030086249962421e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.248762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.40442699778271e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1838115 -0.0454311 1.39776 ] [ -0.0315953 2.0635116 1.1551524 ] [ 0.8078845 2.6892075 3.2169406 ] [ 1.9416562 0.7219177 3.4432525 ] [ 1.8863699 1.597098 -0.1757575 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1838115e-10 -4.54311e-12 1.39776e-10 ] [ -3.15953e-12 2.0635116e-10 1.1551524e-10 ] [ 8.078845000000001e-11 2.6892075e-10 3.2169406e-10 ] [ 1.9416562e-10 7.219177e-11 3.4432525e-10 ] [ 1.8863699e-10 1.597098e-10 -1.757575e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.17e-05 6.9e-06 9.9e-06 ] [ 8.2e-06 -1.5e-05 7.6e-06 ] [ 5.8e-06 -1.17e-05 -1.7e-06 ] [ -8.9e-06 1.1e-05 -6.4e-06 ] [ 6.6e-06 8.8e-06 -9.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.87454666178e-14 1.10550187746e-14 1.58615486766e-14 ] [ 1.31378483988e-14 -2.403264951e-14 1.21765424184e-14 ] [ 9.2926244772e-15 -1.87454666178e-14 -2.7237002778e-15 ] [ -1.42593720426e-14 1.7623942974e-14 -1.02539304576e-14 ] [ 1.05743657844e-14 1.40991543792e-14 -1.50604603596e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.985955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240797030517547e-18 } }