{ "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" [ [ 2.700129 2.133533 1.415237 ] [ 2.985807 2.812498 3.555959 ] [ 1.950344 4.41901 2.566342 ] [ 5.113997 2.527784 1.58139 ] [ 5.483026 3.06067 3.469124 ] [ 3.944653 4.730231 1.719663 ] [ 3.598129 4.831394 3.870985 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.700129e-10 2.133533e-10 1.415237e-10 ] [ 2.985807e-10 2.812498e-10 3.555959e-10 ] [ 1.950344e-10 4.41901e-10 2.566342e-10 ] [ 5.113997e-10 2.527784e-10 1.58139e-10 ] [ 5.483026e-10 3.06067e-10 3.469124e-10 ] [ 3.944653e-10 4.730231e-10 1.719663e-10 ] [ 3.598129e-10 4.831394000000001e-10 3.870985e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3886143 -7.2066699 -5.6281053 ] [ -7.6417019 -18.9516919 16.0759377 ] [ -17.3214357 5.8780028 -5.0138309 ] [ 4.2625252 -4.0531918 -10.5787482 ] [ 8.263136 -1.9490491 9.371667 ] [ 8.7574558 14.7337334 -17.7461915 ] [ 6.0686349 11.5488665 13.5192712 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.826981987568558e-09 -1.154635802760307e-08 -9.01721873106057e-09 ] [ -1.224335612730294e-08 -3.036395768678473e-08 2.575649154037732e-08 ] [ -2.775199931723048e-08 9.417598663156939e-09 -8.033042648624623e-09 ] [ 6.829318221010844e-09 -6.493929141578269e-09 -1.694902304337008e-08 ] [ 1.323900331369083e-08 -3.122720900811281e-09 1.501506576532288e-08 ] [ 1.403099094044936e-08 2.36060431905801e-08 -2.843253312953968e-08 ] [ 9.723024956950947e-09 1.850332390304032e-08 2.166026024689476e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -2.3588899 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.77935824882125e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.5284873 2.2180102 1.7949063 ] [ 3.1528386 1.5228049 4.0016254 ] [ 1.9898991 4.5255704 2.1544874 ] [ 4.8551728 2.8772497 1.4267393 ] [ 5.0191758 3.0195883 3.8632219 ] [ 4.3105576 5.2051766 1.1804554 ] [ 3.9199538 5.1467199 3.7572643 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.5284873e-10 2.2180102e-10 1.7949063e-10 ] [ 3.1528386e-10 1.5228049e-10 4.0016254e-10 ] [ 1.9898991e-10 4.5255704e-10 2.1544874e-10 ] [ 4.8551728e-10 2.8772497e-10 1.4267393e-10 ] [ 5.0191758e-10 3.0195883e-10 3.8632219e-10 ] [ 4.3105576e-10 5.2051766e-10 1.1804554e-10 ] [ 3.9199538e-10 5.1467199e-10 3.7572643e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.3e-05 2e-07 -1.91e-05 ] [ -5.9e-06 -6e-07 -1.3e-06 ] [ -5.8e-06 4.8e-06 2.72e-05 ] [ 3.04e-05 1.05e-05 -7.1e-06 ] [ 2.29e-05 2.1e-06 4.55e-05 ] [ 2.2e-06 2.8e-06 -5.15e-05 ] [ -1.08e-05 -1.98e-05 6.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.28718284864e-14 3.2043532416e-16 -3.060157345728e-14 ] [ -9.45284206272e-15 -9.6130597248e-16 -2.08282960704e-15 ] [ -9.292624400640001e-15 7.69044777984e-15 4.357920408576e-14 ] [ 4.870616927232e-14 1.68228545184e-14 -1.137545400768e-14 ] [ 3.668984461632e-14 3.36457090368e-15 7.28990362464e-14 ] [ 3.52478856576e-15 4.48609453824e-15 -8.25120959712e-14 ] [ -1.730350750464e-14 -3.172309709184e-14 1.025393037312e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.086282 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.057959479839587e-18 } }