{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.93382 1.245152 2.813835 ] [ 2.031103 3.253162 4.119437 ] [ 5.029042 2.355016 2.700294 ] [ 3.923156 2.081195 4.901301 ] [ 3.286942 3.48059 1.880825 ] [ 4.655074 4.019286 4.063597 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.93382e-10 1.245152e-10 2.813835e-10 ] [ 2.031103e-10 3.253162e-10 4.119437e-10 ] [ 5.029042e-10 2.355016e-10 2.700294e-10 ] [ 3.923156e-10 2.081195e-10 4.901301000000001e-10 ] [ 3.286942e-10 3.48059e-10 1.880825e-10 ] [ 4.655074e-10 4.019286e-10 4.063597e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.4448002 -5.4277336 -1.0158679 ] [ -3.9837293 2.1986652 -0.3551652 ] [ 13.8272859 -10.8652516 -6.7568138 ] [ -0.3588736 -8.8141101 9.1354801 ] [ -7.1711112 6.6020531 -6.1154379 ] [ 2.1312285 16.3063769 5.1078047 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.121354964567165e-09 -8.696187877850619e-09 -1.627599799201192e-09 ] [ -6.382637948055949e-09 3.522649980406557e-09 -5.690373799617562e-10 ] [ 2.215375419809749e-08 -1.74080520926298e-08 -1.082560910145881e-08 ] [ -5.74978891742331e-10 -1.412176113537715e-08 1.463665263600365e-08 ] [ -1.148938670979703e-08 1.057765512610016e-08 -9.798011629334248e-09 ] [ 3.414604476282653e-09 2.612569583913318e-08 8.183605273952358e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -10.862107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.740301388802803e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8064934 1.2135 2.790661 ] [ 2.0425641 3.3258978 4.1263864 ] [ 5.2438154 2.152237 2.7000435 ] [ 4.034244 1.87694 5.0002874 ] [ 3.2521339 3.6011931 1.8261422 ] [ 4.4798861 4.2646331 4.0357685 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8064934e-10 1.2135e-10 2.790661e-10 ] [ 2.0425641e-10 3.3258978e-10 4.1263864e-10 ] [ 5.2438154e-10 2.152237e-10 2.7000435e-10 ] [ 4.034244e-10 1.87694e-10 5.000287400000001e-10 ] [ 3.2521339e-10 3.6011931e-10 1.8261422e-10 ] [ 4.4798861e-10 4.264633100000001e-10 4.0357685e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 5.2e-06 3.2e-06 3.5e-06 ] [ -2.9e-06 -6e-07 1.4e-06 ] [ -2.1e-06 -9.7e-06 -3.6e-06 ] [ 2.3e-06 -3.5e-06 1.7e-06 ] [ 3.6e-06 5.4e-06 -2.6e-06 ] [ -6e-06 5.1e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 8.33131842816e-15 5.126965186560001e-15 5.6076181728e-15 ] [ -4.646312200320001e-15 -9.6130597248e-16 2.24304726912e-15 ] [ -3.36457090368e-15 -1.554111322176e-14 -5.76783583488e-15 ] [ 3.68500622784e-15 -5.6076181728e-15 2.72370025536e-15 ] [ 5.76783583488e-15 8.65175375232e-15 -4.16565921408e-15 ] [ -9.6130597248e-15 8.17110076608e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -16.315328 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.614003708228362e-18 } }