{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.851893 1.689536 1.360291 ] [ 1.367517 2.93292 5.4803 ] [ 1.756353 1.339195 3.328571 ] [ 1.204701 3.536746 3.011508 ] [ 3.888723 1.68848 3.240915 ] [ 3.83892 3.544284 1.733331 ] [ 3.269318 3.65155 3.991072 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.851893e-10 1.689536e-10 1.360291e-10 ] [ 1.367517e-10 2.93292e-10 5.4803e-10 ] [ 1.756353e-10 1.339195e-10 3.328571e-10 ] [ 1.204701e-10 3.536746e-10 3.011508e-10 ] [ 3.888723e-10 1.68848e-10 3.240915e-10 ] [ 3.83892e-10 3.544284e-10 1.733331e-10 ] [ 3.269318e-10 3.65155e-10 3.991072e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.6164523 -3.0421017 -5.2533256 ] [ 0.5231591 0.1257922 -1.6356484 ] [ -4.3363996 -2.1094663 1.5739994 ] [ -2.0691374 1.4425385 0.3307542 ] [ 7.0041969 -2.9910002 2.1063648 ] [ 1.621325 2.9977436 0.1815401 ] [ -0.1266916 3.5764938 2.6963154 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.192018704498388e-09 -4.873984221835936e-09 -8.416755457770133e-09 ] [ 8.381932789787692e-10 2.015413219189978e-10 -2.620597626328927e-09 ] [ -6.947678057566471e-09 -3.379737588225479e-09 2.521825039833228e-09 ] [ -3.315123567502898e-09 2.311201459303901e-09 5.299266464714074e-10 ] [ 1.122196052065984e-08 -4.792110593248125e-09 3.374768437436068e-09 ] [ 2.59764900971856e-09 4.802914711072827e-09 2.908593039576941e-10 ] [ -2.029823195717453e-10 5.730174750796151e-09 4.319973496183001e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.488594158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.793697242495365e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.4278341 1.7254564 1.3937148 ] [ 1.247908 2.9940518 5.0178739 ] [ 1.8351801 1.1204368 3.6394558 ] [ 1.3748964 3.5155648 2.716369 ] [ 4.1578273 1.6406503 3.1579858 ] [ 3.6941881 3.7284826 1.9175201 ] [ 3.439591 3.6580681 4.3030686 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4278341e-10 1.7254564e-10 1.3937148e-10 ] [ 1.247908e-10 2.9940518e-10 5.017873899999999e-10 ] [ 1.8351801e-10 1.1204368e-10 3.6394558e-10 ] [ 1.3748964e-10 3.5155648e-10 2.716369e-10 ] [ 4.1578273e-10 1.6406503e-10 3.1579858e-10 ] [ 3.6941881e-10 3.7284826e-10 1.9175201e-10 ] [ 3.439591e-10 3.6580681e-10 4.3030686e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8.7e-06 2.28e-05 2.3e-06 ] [ -9.7e-06 -1.44e-05 -1.73e-05 ] [ 2.67e-05 2.52e-05 2.53e-05 ] [ 3.54e-05 2.01e-05 2.4e-06 ] [ 1.84e-05 -1.5e-05 5.6e-06 ] [ -2.97e-05 -1.66e-05 2e-06 ] [ -3.23e-05 -2.22e-05 -2.03e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393893660096e-14 3.652962695424e-14 3.68500622784e-15 ] [ -1.554111322176e-14 -2.307134333952e-14 -2.771765553984e-14 ] [ 4.277811577536e-14 4.037485084416e-14 4.053506850624e-14 ] [ 5.671705237632e-14 3.220375007808e-14 3.84522388992e-15 ] [ 2.948004982272e-14 -2.4032649312e-14 8.972189076479999e-15 ] [ -4.758464563776e-14 -2.659613190528e-14 3.2043532416e-15 ] [ -5.175030485184e-14 -3.556832098176e-14 -3.252418540224e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.103202158928926 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.298276105265201e-18 } }