{ "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" [ [ 0.284773 1.136187 2.117179 ] [ 0.232979 2.36751 0.607179 ] [ 0.4870779 2.766051 2.845032 ] [ 1.778488 1.070505 1.035652 ] [ 2.177899 0.7799475 2.527686 ] [ 2.528264 2.860392 0.629956 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.84773e-11 1.136187e-10 2.117179e-10 ] [ 2.32979e-11 2.36751e-10 6.07179e-11 ] [ 4.870779e-11 2.766051e-10 2.845032e-10 ] [ 1.778488e-10 1.070505e-10 1.035652e-10 ] [ 2.177899e-10 7.799475000000001e-11 2.527686e-10 ] [ 2.528264e-10 2.860392e-10 6.29956e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -12.8427053 -8.1010342 6.1385687 ] [ -6.7060275 6.7339268 -7.9952236 ] [ -4.4237533 8.8162021 8.2827397 ] [ 3.1984342 -6.1789544 -24.3077162 ] [ 13.2344614 -9.2818666 23.4936974 ] [ 7.5395905 8.0117264 -5.6120659 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.057628217948425e-08 -1.297928759954123e-08 9.835071256314651e-09 ] [ -1.074424047894187e-08 1.078894008513856e-08 -1.280976032998841e-08 ] [ -7.087634113446849e-09 1.412511288886786e-08 1.327041190351201e-08 ] [ 5.124456498407151e-09 -9.899776280669293e-09 -3.894525460068143e-08 ] [ 2.120394464396004e-08 -1.487118966390439e-08 3.764105271042975e-08 ] [ 1.207975562950578e-08 1.283620073032615e-08 -8.991520779368911e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.9333045 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 4.699671891587434e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.1177665 1.3459944 2.5821604 ] [ -0.3027594 2.1504948 0.2741516 ] [ 1.1288611 3.4213142 2.9659802 ] [ 3.1682537 1.1146295 0.9437391 ] [ 1.694761 -0.1627001 2.3304635 ] [ 1.918131 3.1108597 0.6661893 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.177665e-11 1.3459944e-10 2.5821604e-10 ] [ -3.027594e-11 2.1504948e-10 2.741516e-11 ] [ 1.1288611e-10 3.4213142e-10 2.9659802e-10 ] [ 3.1682537e-10 1.1146295e-10 9.437391000000001e-11 ] [ 1.694761e-10 -1.627001e-11 2.3304635e-10 ] [ 1.918131e-10 3.1108597e-10 6.661893e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.13e-05 9.2e-06 2.82e-05 ] [ -1.25e-05 -2.41e-05 -2.59e-05 ] [ 2.24e-05 -3e-07 -1.3e-06 ] [ 1.69e-05 2.39e-05 -4.5e-06 ] [ -1.44e-05 -2.19e-05 -3.9e-06 ] [ 8.8e-06 1.32e-05 7.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.412636202304e-14 1.474002491136e-14 4.518138070656001e-14 ] [ -2.002720776e-14 -3.861245656128e-14 -4.149637447872e-14 ] [ 3.588875630592e-14 -4.8065298624e-16 -2.08282960704e-15 ] [ 2.707678489152e-14 3.829202123712e-14 -7.2097947936e-15 ] [ -2.307134333952e-14 -3.508766799552e-14 -6.24848882112e-15 ] [ 1.409915426304e-14 2.114873139456e-14 1.2016324656e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.186062 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.753510674001929e-18 } }