{ "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" [ [ 1.662864 2.785445 0.9951273 ] [ 1.604551 1.254517 2.754062 ] [ 1.304297 2.979259 4.142484 ] [ 2.049326 4.702389 2.752286 ] [ 3.428978 2.585226 4.349041 ] [ 3.762165 3.432195 2.245626 ] [ 3.938407 4.831482 3.738967 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.662864e-10 2.785445e-10 9.951273000000001e-11 ] [ 1.604551e-10 1.254517e-10 2.754062e-10 ] [ 1.304297e-10 2.979259e-10 4.142484e-10 ] [ 2.049326e-10 4.702389e-10 2.752286e-10 ] [ 3.428978e-10 2.585226e-10 4.349041e-10 ] [ 3.762165e-10 3.432195e-10 2.245626e-10 ] [ 3.938407e-10 4.831482000000001e-10 3.738967e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.579059 0.2255348 -1.809042 ] [ 0.2724341 -2.7747777 -0.4602145 ] [ -5.9326329 1.2182933 3.960125 ] [ -14.4381717 8.3833655 -1.7285665 ] [ 2.2129873 -8.1404409 5.3269616 ] [ 9.2800362 -9.4930439 -12.3449343 ] [ 8.0262878 10.581069 7.0556708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.277547995074059e-10 3.613465867138632e-10 -2.898404822324628e-09 ] [ 4.364875493248194e-10 -4.445683995484261e-09 -7.37344918527993e-10 ] [ -9.505125810479657e-09 1.951921058618752e-09 6.34481974271925e-09 ] [ -2.313250133542005e-08 1.343163231838173e-08 -2.769468856615161e-09 ] [ 3.545596543398748e-09 -1.304242420043793e-08 8.534733405735253e-09 ] [ 1.486825716231415e-08 -1.520953312211623e-08 -1.977876528372514e-08 ] [ 1.285953077091926e-08 1.695274151454174e-08 1.130443089295609e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.8972817 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.26528402118558e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.0863862 3.068299 1.1528655 ] [ 1.2639559 1.2030501 2.6204622 ] [ 1.2195301 2.9989423 4.4570433 ] [ 1.4603385 4.7883074 2.8422652 ] [ 3.5526634 2.2855081 4.329497 ] [ 4.3033878 3.0330606 2.1280512 ] [ 3.8643262 5.1933455 3.4474088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.0863862e-10 3.068299e-10 1.1528655e-10 ] [ 1.2639559e-10 1.2030501e-10 2.6204622e-10 ] [ 1.2195301e-10 2.9989423e-10 4.4570433e-10 ] [ 1.4603385e-10 4.7883074e-10 2.8422652e-10 ] [ 3.5526634e-10 2.2855081e-10 4.329497e-10 ] [ 4.3033878e-10 3.0330606e-10 2.1280512e-10 ] [ 3.8643262e-10 5.1933455e-10 3.4474088e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.38e-05 -2.12e-05 1.58e-05 ] [ 4.39e-05 6e-07 -1.35e-05 ] [ -6.4e-05 8.53e-05 5.25e-05 ] [ 3e-05 -2.83e-05 9.7e-06 ] [ 1.88e-05 -6.26e-05 -7.59e-05 ] [ -3.53e-05 5.99e-05 4.83e-05 ] [ -1.72e-05 -3.37e-05 -3.71e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.81318038892e-14 -3.39661446408e-14 2.53143908172e-14 ] [ 7.03355542326e-14 9.613059803999998e-16 -2.162938455899999e-14 ] [ -1.02539304576e-13 1.366656668802e-13 8.4114273285e-14 ] [ 4.806529901999999e-14 -4.53415987422e-14 1.55411133498e-14 ] [ 3.012092071919999e-14 -1.002962572884e-13 -1.216052065206e-13 ] [ -5.655683518019999e-14 9.597038037659999e-14 7.73851314222e-14 ] [ -2.75574381048e-14 -5.399335256579999e-14 -5.94407531214e-14 ] ] } "relaxed-potential-energy" { "source-value" -18.714404 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.998378080803613e-18 } }