{ "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" [ [ 2.619068 2.165174 1.589354 ] [ 4.694039 1.985014 2.658467 ] [ 3.289805 2.94692 4.226906 ] [ 3.352089 4.483007 2.429606 ] [ 5.033516 4.030044 3.913159 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.619068e-10 2.165174e-10 1.589354e-10 ] [ 4.694039000000001e-10 1.985014e-10 2.658467e-10 ] [ 3.289805e-10 2.94692e-10 4.226906e-10 ] [ 3.352089e-10 4.483007e-10 2.429606e-10 ] [ 5.033516e-10 4.030044e-10 3.913159e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1851905 1.2598379 1.5077034 ] [ 2.1786797 -1.7517108 -0.945275 ] [ -6.9721569 -3.9594662 1.4843178 ] [ -1.8284549 1.0964723 -2.4559406 ] [ 6.8071227 3.3548667 0.4091944 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.96707891938777e-10 2.018482846007628e-09 2.415607158482355e-09 ] [ 3.490629708310129e-09 -2.806550113285447e-09 -1.51449751770435e-09 ] [ -1.117062687376187e-08 -6.343764228752771e-09 2.378139296590285e-09 ] [ -2.929507717102806e-09 1.756742298888238e-09 -3.93485064381194e-09 ] [ 1.090621293471099e-08 5.375089036924687e-09 6.556017064436495e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.349049 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.978535775992106e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.8129876 2.3819819 1.7158102 ] [ 4.8631226 1.7346246 2.8450205 ] [ 3.0573747 2.8154101 4.131808 ] [ 3.1024535 4.6627506 2.4978144 ] [ 5.1525786 4.0153918 3.6270389 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.8129876e-10 2.3819819e-10 1.7158102e-10 ] [ 4.8631226e-10 1.7346246e-10 2.8450205e-10 ] [ 3.0573747e-10 2.8154101e-10 4.131808000000001e-10 ] [ 3.1024535e-10 4.6627506e-10 2.4978144e-10 ] [ 5.1525786e-10 4.0153918e-10 3.6270389e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.54e-05 -6.3e-06 1.41e-05 ] [ -3.52e-05 2.39e-05 1.39e-05 ] [ 2.73e-05 -1e-06 -3.75e-05 ] [ 2.9e-06 -7e-06 1.61e-05 ] [ -1.04e-05 -9.6e-06 -6.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.46735201636e-14 -1.00937127942e-14 2.25906905394e-14 ] [ -5.63966175168e-14 3.82920215526e-14 2.22702552126e-14 ] [ 4.37394221082e-14 -1.602176634e-15 -6.008162377499999e-14 ] [ 4.6463122386e-15 -1.1215236438e-14 2.579504380739999e-14 ] [ -1.66626369936e-14 -1.53808956864e-14 -1.05743657844e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.391586 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.305786281540152e-18 } }