{ "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" [ [ -1.297729208856002e-08 -4.850992362478574e-08 -9.931481112947656e-09 ] [ -4.893908345552154e-08 7.763612136534805e-09 -4.259440539748921e-08 ] [ -2.35873223976367e-08 8.226533225285296e-08 5.374453248957314e-08 ] [ 5.613372790677758e-08 -5.453114417289823e-08 3.908221618845752e-08 ] [ 2.936996987472301e-08 1.301212324807856e-08 -4.030086216759379e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 21.248762 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.404426969734345e-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" [ [ -1.874546646336e-14 1.105501868352e-14 1.586154854592e-14 ] [ 1.313784829056e-14 -2.4032649312e-14 1.217654231808e-14 ] [ 9.292624400640001e-15 -1.874546646336e-14 -2.72370025536e-15 ] [ -1.425937192512e-14 1.76239428288e-14 -1.025393037312e-14 ] [ 1.057436569728e-14 1.409915426304e-14 -1.506046023552e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.985955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.240797012056086e-18 } }