{ "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" [ [ 0.1126891 1.464287 0.6414025 ] [ 1.365449 0.1265984 2.502806 ] [ 0.3364486 2.37729 2.80341 ] [ 2.851665 1.424041 0.0715282 ] [ 2.597469 0.5436052 1.609588 ] [ 2.328633 2.330176 2.375244 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.126891e-11 1.464287e-10 6.414025e-11 ] [ 1.365449e-10 1.265984e-11 2.502806e-10 ] [ 3.364486e-11 2.37729e-10 2.80341e-10 ] [ 2.851665e-10 1.424041e-10 7.15282e-12 ] [ 2.597469e-10 5.436052e-11 1.609588e-10 ] [ 2.328633e-10 2.330176e-10 2.375244e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.9924028 3.9127862 -10.4463207 ] [ -49.1722361 -28.0958428 35.4280224 ] [ -13.9640119 5.1100439 5.3747941 ] [ -2.2381355 14.8531607 -27.7444896 ] [ 59.6576352 -22.0080089 -10.1213442 ] [ 13.7091511 26.2278608 7.5093379 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.280524091017646e-08 6.268974571828873e-09 -1.673685079891909e-08 ] [ -7.878260707187776e-08 -4.5014502475832e-08 5.676194921045872e-08 ] [ -2.237281339875299e-08 8.187192867841654e-09 8.611369448633777e-09 ] [ -3.585888372282518e-09 2.379738681852536e-08 -4.445157259314875e-08 ] [ 9.558206836965514e-08 -3.526071732993832e-08 -1.621618104830968e-08 ] [ 2.19644813834346e-08 4.202166538735678e-08 1.203128562106737e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 45.553028 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 7.298399646824778e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.0034338 1.6032818 0.594148 ] [ 1.3104735 -0.212681 2.5864003 ] [ 0.0558455 2.6726967 2.8771342 ] [ 2.830889 1.411854 -0.0707058 ] [ 3.0986228 -0.0245328 1.4820282 ] [ 2.2930891 2.8153789 2.5349739 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.4338e-13 1.6032818e-10 5.94148e-11 ] [ 1.3104735e-10 -2.12681e-11 2.5864003e-10 ] [ 5.58455e-12 2.6726967e-10 2.8771342e-10 ] [ 2.830889e-10 1.411854e-10 -7.07058e-12 ] [ 3.0986228e-10 -2.45328e-12 1.4820282e-10 ] [ 2.2930891e-10 2.8153789e-10 2.5349739e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.7102323 1.0624767 0.7165829 ] [ 1.6550428 -0.074877 -1.3885588 ] [ -0.7464211 1.1663363 0.0462064 ] [ 0.211956 -1.4448918 1.1864939 ] [ 0.874701 -1.3409559 -0.6499552 ] [ -1.2850464 0.6319117 0.0892309 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.137917586397012e-09 1.702275328884735e-09 1.148092369245064e-09 ] [ 2.65167088058337e-09 -1.199661788356416e-10 -2.224716445966103e-09 ] [ -1.195898435691819e-09 1.868676751850375e-09 7.403081381133312e-11 ] [ 3.395909478382848e-10 -2.31497186154563e-09 1.900972787301813e-09 ] [ 1.401425492390381e-09 -2.148448192503823e-09 -1.041343026007388e-09 ] [ -2.058871298723205e-09 1.012434152149983e-09 1.429636618329427e-10 ] ] } "relaxed-potential-energy" { "source-value" -14.450491 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.315223883928082e-18 } }