{ "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" [ [ 1.032434 0.1172693 0.4247075 ] [ 0.2432392 0.0735251 2.276612 ] [ 0.5624588 1.720194 2.530042 ] [ 2.331345 1.198395 0.9085221 ] [ 2.704395 0.5611016 2.497073 ] [ 2.283372 2.154556 2.294867 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.032434e-10 1.172693e-11 4.247075e-11 ] [ 2.432392e-11 7.35251e-12 2.276612e-10 ] [ 5.624588000000001e-11 1.720194e-10 2.530042e-10 ] [ 2.331345e-10 1.198395e-10 9.085221e-11 ] [ 2.704395e-10 5.611016e-11 2.497073e-10 ] [ 2.283372e-10 2.154556e-10 2.294867e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -185.9868439 -161.2876453 -93.1357143 ] [ -88.738913 -437.8065126 -43.990009 ] [ -103.7118093 386.6888766 89.5656504 ] [ 147.6701345 -16.487242 -591.0370121 ] [ 207.8314268 -694.5849679 329.1830968 ] [ 22.936005 923.4774912 309.4139882 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.979837730729591e-07 -2.58411294523543e-07 -1.492198640129683e-07 ] [ -1.421754117638052e-07 -7.014433589217006e-07 -7.047976396858159e-08 ] [ -1.66164636161328e-07 6.195438776119362e-07 1.434999910976262e-07 ] [ 2.365936370862915e-07 -2.641547367387183e-08 -9.469456828141068e-07 ] [ 3.329826530864666e-07 -1.112847796728498e-06 5.274094616555033e-07 ] [ 3.674753098555191e-08 1.479574046235678e-06 4.957358580425271e-07 ] ] } "unrelaxed-potential-energy" { "source-value" 227.30378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.641808021354666e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.9680992 -0.0063841 0.6190061 ] [ 0.2179386 -0.3146645 2.6845419 ] [ 0.645414 1.7275594 1.9604538 ] [ 2.4116069 1.6730126 0.6233899 ] [ 2.3158042 0.2907609 2.3526577 ] [ 2.5983811 2.4547567 2.6917742 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.680992e-11 -6.3841e-13 6.190061e-11 ] [ 2.179386e-11 -3.146645e-11 2.6845419e-10 ] [ 6.454140000000001e-11 1.7275594e-10 1.9604538e-10 ] [ 2.4116069e-10 1.6730126e-10 6.233899000000001e-11 ] [ 2.3158042e-10 2.907609e-11 2.3526577e-10 ] [ 2.5983811e-10 2.4547567e-10 2.6917742e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.53e-05 8.38e-05 1.56e-05 ] [ 1.1e-06 -7.71e-05 2.88e-05 ] [ 6.63e-05 -5.62e-05 -4.11e-05 ] [ 4.03e-05 -3.87e-05 8.73e-05 ] [ -4.37e-05 0.0001437 -2.59e-05 ] [ -1.86e-05 -5.54e-05 -6.48e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.257860092224001e-14 1.3426240082304e-13 2.499395528448e-14 ] [ 1.76239428288e-15 -1.2352781746368e-13 4.614268667904e-14 ] [ 1.0622430995904e-13 -9.004232608896e-14 -6.584945911488e-14 ] [ 6.456771781824e-14 -6.200423522496e-14 1.3987001899584e-13 ] [ -7.001511832895999e-14 2.3023278040896e-13 -4.149637447872e-14 ] [ -2.980048514688e-14 -8.876058479231999e-14 -1.0382104502784e-13 ] ] } "relaxed-potential-energy" { "source-value" -39.006818 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.249581185140063e-18 } }