{ "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" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.9201774 -0.3213144 -0.4153848 ] [ 0.0428811 -0.3491665 0.4109686 ] [ 1.131445 0.6543932 -0.379275 ] [ -1.3352594 0.4226341 1.0100479 ] [ 0.7459968 -1.7231857 -3.7376873 ] [ 0.467457 2.2402314 0.4896399 ] [ -0.1323431 -0.9235921 2.6216907 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.47428671726853e-09 -5.148024196063795e-10 -6.655198151956838e-10 ] [ 6.870309589418688e-11 -5.594264030665631e-10 6.584442828029069e-10 ] [ 1.812774726721056e-09 1.048453485850499e-09 -6.076655378539199e-10 ] [ -2.139321393383435e-09 6.771344741728494e-10 1.618275131268136e-09 ] [ 1.195218632151613e-09 -2.760847841836883e-09 -5.988435207921076e-09 ] [ 7.489486766293056e-10 3.589246374262053e-09 7.844896003908499e-10 ] [ -2.120370207441965e-10 -1.479757669775576e-09 4.200411546508787e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -20.573193 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.296188883980621e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5592375 3.0810081 2.0640808 ] [ 2.5693984 1.9868745 2.0137636 ] [ 2.3747475 2.7494403 4.2534769 ] [ 1.2293025 4.7010995 3.5360627 ] [ 4.1448721 3.6263466 1.5901796 ] [ 3.2002169 5.5396569 2.6632843 ] [ 4.3573858 3.9139641 3.9224941 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.592375000000001e-11 3.0810081e-10 2.0640808e-10 ] [ 2.5693984e-10 1.9868745e-10 2.0137636e-10 ] [ 2.3747475e-10 2.7494403e-10 4.2534769e-10 ] [ 1.2293025e-10 4.7010995e-10 3.5360627e-10 ] [ 4.1448721e-10 3.6263466e-10 1.5901796e-10 ] [ 3.2002169e-10 5.5396569e-10 2.6632843e-10 ] [ 4.357385800000001e-10 3.9139641e-10 3.9224941e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.18e-05 4.11e-05 -7.06e-05 ] [ 1.75e-05 -1.63e-05 4.53e-05 ] [ 2.76e-05 -2.89e-05 5.16e-05 ] [ 2.82e-05 -9.4e-06 2.49e-05 ] [ -2.04e-05 6.3e-05 4.64e-05 ] [ 1e-07 -2.95e-05 -4.84e-05 ] [ -3.11e-05 -2e-05 -4.93e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.492745033344e-14 6.584945911488e-14 -1.1311366942848e-13 ] [ 2.8038090864e-14 -2.611547891904e-14 7.257860092224001e-14 ] [ 4.422007473408001e-14 -4.630290434112001e-14 8.267231363328e-14 ] [ 4.518138070656001e-14 -1.506046023552e-14 3.989419785791999e-14 ] [ -3.268440306432e-14 1.009371271104e-13 7.434099520512001e-14 ] [ 1.6021766208e-16 -4.72642103136e-14 -7.754534844671999e-14 ] [ -4.982769290688e-14 -3.2043532416e-14 -7.898730740544e-14 ] ] } "relaxed-potential-energy" { "source-value" -22.704295 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.637629064074633e-18 } }