{ "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" [ [ 0.0409962 0.6822116 1.595736 ] [ 0.3790876 1.575629 0.6188876 ] [ 0.3154214 2.976467 2.437822 ] [ 1.63698 0.1180447 0.631717 ] [ 1.584423 0.2949968 2.813326 ] [ 2.305753 1.803926 1.00695 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.099619999999999e-12 6.822116000000001e-11 1.595736e-10 ] [ 3.790876e-11 1.575629e-10 6.188876e-11 ] [ 3.154214e-11 2.976467e-10 2.437822e-10 ] [ 1.63698e-10 1.180447e-11 6.31717e-11 ] [ 1.584423e-10 2.949968e-11 2.813326e-10 ] [ 2.305753e-10 1.803926e-10 1.00695e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -49.7878383 -59.1796784 66.5233274 ] [ -5.1147347 76.2296148 -72.6992653 ] [ 1.0861122 3.1227323 -0.4943172 ] [ 17.8950477 -37.405739 -17.6085602 ] [ 10.7334891 -8.268934 21.1685906 ] [ 25.1879241 25.5020044 3.1102246 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.976891118163027e-08 -9.481629794011451e-08 1.06582120776212e-07 ] [ -8.194708425448999e-09 1.221333076513806e-07 -1.16477064172627e-07 ] [ 1.740143588742335e-09 5.003168725297078e-09 -7.919834676243048e-10 ] [ 2.867102728925544e-08 -5.993060100330252e-08 -2.821202371082237e-08 ] [ 1.719694543731369e-08 -1.324829284288815e-08 3.391582123403204e-08 ] [ 4.035550345198548e-08 4.085871556984518e-08 4.983129180611995e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 36.697173 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 5.879535311445568e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.2469894 0.5992139 2.1655171 ] [ 0.2660928 1.9503628 -0.1163582 ] [ 0.1587339 3.1179113 2.2099227 ] [ 1.5965024 -0.2281284 0.3730774 ] [ 2.0987688 -0.0588507 2.9236357 ] [ 2.3895527 2.0707663 1.5486439 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.469894e-11 5.992139e-11 2.1655171e-10 ] [ 2.660928e-11 1.9503628e-10 -1.163582e-11 ] [ 1.587339e-11 3.1179113e-10 2.2099227e-10 ] [ 1.5965024e-10 -2.281284e-11 3.730774e-11 ] [ 2.0987688e-10 -5.88507e-12 2.9236357e-10 ] [ 2.3895527e-10 2.0707663e-10 1.5486439e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.15e-05 5.04e-05 3.53e-05 ] [ -1.9e-06 -2.04e-05 -1.83e-05 ] [ -4.6e-05 1.21e-05 8.3e-06 ] [ 1.43e-05 -2.72e-05 -6.58e-05 ] [ 3.52e-05 -6e-07 2.8e-06 ] [ 3.99e-05 -1.43e-05 3.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.649033031099999e-14 8.074970235359998e-14 5.655683518019999e-14 ] [ -3.0441356046e-15 -3.26844033336e-14 -2.93198324022e-14 ] [ -7.370012516399999e-14 1.93863372714e-14 1.32980660622e-14 ] [ 2.29111258662e-14 -4.35792044448e-14 -1.054232225172e-13 ] [ 5.63966175168e-14 -9.613059803999998e-16 4.486094575199999e-15 ] [ 6.392684769659999e-14 -2.29111258662e-14 6.056227676519999e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.22977 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.119642836719418e-18 } }