{ "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" [ [ 1.137834 0.6178187 0.8180482 ] [ 0.8147489 0.2195668 2.521416 ] [ 0.6602072 2.742467 0.5700192 ] [ 2.747217 2.135327 0.0253318 ] [ 2.249122 2.278269 1.668886 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.137834e-10 6.178187000000001e-11 8.180482000000001e-11 ] [ 8.147489e-11 2.195668e-11 2.521416e-10 ] [ 6.602072e-11 2.742467e-10 5.700191999999999e-11 ] [ 2.747217e-10 2.135327e-10 2.53318e-12 ] [ 2.249122e-10 2.278269e-10 1.668886e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5023895 -4.3635991 -21.6561725 ] [ -2.9170007 -3.9671867 20.1421854 ] [ -11.7849231 7.2396443 -5.2881893 ] [ 12.2427586 -2.1802311 -27.430865 ] [ 1.9567758 3.2713726 34.2330414 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.049167114354016e-10 -6.991256460563921e-09 -3.469701327551189e-08 ] [ -4.673550324397235e-09 -6.356133781088704e-09 3.22713385396991e-08 ] [ -1.888152826874586e-08 1.159918884036798e-08 -8.472613262824718e-09 ] [ 1.961506160301814e-08 -3.493115296361066e-09 -4.394909059132099e-08 ] [ 3.135100438907217e-09 5.24131669764571e-09 5.48473785899585e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.2314789 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.973046702588501e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.8766855 0.4765075 0.3294181 ] [ 1.2143475 0.289787 2.6204913 ] [ 0.6103961 2.8987484 0.3956066 ] [ 2.8135565 1.9175184 -0.00906 ] [ 2.0941435 2.4108872 2.2672452 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.766855000000001e-11 4.765075e-11 3.294181e-11 ] [ 1.2143475e-10 2.89787e-11 2.6204913e-10 ] [ 6.103961e-11 2.8987484e-10 3.956066e-11 ] [ 2.8135565e-10 1.9175184e-10 -9.060000000000001e-13 ] [ 2.0941435e-10 2.4108872e-10 2.2672452e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.64e-05 9e-06 1.63e-05 ] [ -6.2e-06 2.8e-06 -1.4e-05 ] [ 8.8e-06 -5.9e-06 5e-06 ] [ -1.23e-05 -4.8e-06 -1.01e-05 ] [ -6.6e-06 -1.1e-06 2.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.627569658112e-14 1.44195895872e-14 2.611547891904e-14 ] [ -9.93349504896e-15 4.48609453824e-15 -2.24304726912e-14 ] [ 1.409915426304e-14 -9.45284206272e-15 8.010883104e-15 ] [ -1.970677243584e-14 -7.69044777984e-15 -1.618198387008e-14 ] [ -1.057436569728e-14 -1.76239428288e-15 4.48609453824e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.004913 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.243834418493799e-18 } }