{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.6447348e-10 1.8524193e-10 1.9616612e-10 ] [ 1.294282e-10 2.3122895e-10 4.2550522e-10 ] [ 2.8100285e-10 3.7422889e-10 1.1479428e-10 ] [ 3.3774614e-10 2.47568e-11 2.0684863e-10 ] [ 4.9669804e-10 3.5400735e-10 2.1032912e-10 ] [ 4.841831e-10 1.555897e-10 3.3840293e-10 ] [ 3.4507669e-10 2.11528e-10 5.213409000000001e-10 ] ] "source-value" [ [ 1.6447348 1.8524193 1.9616612 ] [ 1.294282 2.3122895 4.2550522 ] [ 2.8100285 3.7422889 1.1479428 ] [ 3.3774614 0.247568 2.0684863 ] [ 4.9669804 3.5400735 2.1032912 ] [ 4.841831 1.555897 3.3840293 ] [ 3.4507669 2.11528 5.213409 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -8.586224728529281e-12 -3.811097527896961e-12 3.04461623250624e-12 ] [ 8.1174278492832e-12 -2.48962225106112e-12 -1.43699221119552e-12 ] [ 4.440272286885119e-12 2.32988524196736e-12 -5.38299301056384e-12 ] [ -7.07553239277696e-12 -3.807732956993281e-12 -2.0876361369024e-13 ] [ 2.87494572836352e-12 5.61995493278016e-12 1.67315304510144e-12 ] [ 3.41487924957312e-12 4.97620036654272e-12 3.99086174475072e-12 ] [ -3.18576799279872e-12 -2.8174275876768e-12 -1.6798821869088e-12 ] ] "source-value" [ [ -0.0053591 -0.0023787 0.0019003 ] [ 0.0050665 -0.0015539 -0.0008969 ] [ 0.0027714 0.0014542 -0.0033598 ] [ -0.0044162 -0.0023766 -0.0001303 ] [ 0.0017944 0.0035077 0.0010443 ] [ 0.0021314 0.0031059 0.0024909 ] [ -0.0019884 -0.0017585 -0.0010485 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.889900444942068e-18 "source-value" -18.03734 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -2.232078623778107e-08 -7.070638223853402e-09 -2.352587828335837e-08 ] [ -4.015663743254262e-08 -1.576605673649071e-08 3.004610923699668e-08 ] [ -1.115049671423035e-08 3.175305330855442e-08 -8.391848660893824e-09 ] [ 5.986800827550198e-09 -2.962993040146026e-08 -1.603044856332578e-08 ] [ 3.96311717264365e-08 1.679314295405557e-08 -2.807649423651227e-08 ] [ 1.920567872005418e-08 -1.721193445900753e-08 1.625826237747265e-08 ] [ 8.804269270730828e-09 2.113236355820191e-08 2.972029828983857e-08 ] ] "source-value" [ [ -13.9315391 -4.4131453 -14.6836984 ] [ -25.0638019 -9.8403987 18.7533065 ] [ -6.9595927 19.8186972 -5.23778 ] [ 3.7366672 -18.4935481 -10.0054191 ] [ 24.735832 10.4814555 -17.5239695 ] [ 11.9872419 -10.7428446 10.1476093 ] [ 5.4951927 13.189784 18.5499513 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" 1.611430152091092e-18 "source-value" 10.057756 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 1.899847e-10 1.906187e-10 1.523281e-10 ] [ 1.884769e-10 1.70171e-10 3.709853e-10 ] [ 2.49478e-10 3.91064e-10 2.644859e-10 ] [ 3.453021e-10 2.240813e-11 2.013003e-10 ] [ 4.505277e-10 2.817941e-10 2.046258e-10 ] [ 4.372743e-10 1.259433e-10 3.808578e-10 ] [ 3.775648e-10 3.545824e-10 4.38804e-10 ] ] "source-value" [ [ 1.899847 1.906187 1.523281 ] [ 1.884769 1.70171 3.709853 ] [ 2.49478 3.91064 2.644859 ] [ 3.453021 0.2240813 2.013003 ] [ 4.505277 2.817941 2.046258 ] [ 4.372743 1.259433 3.808578 ] [ 3.775648 3.545824 4.38804 ] ] } "instance-id" 1 }