{ "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" [ [ 2.430797 0.9143471 3.003228 ] [ 2.900858 2.600657 5.132587 ] [ 1.698571 3.470708 2.452381 ] [ 4.30988 2.177249 1.737833 ] [ 5.127339 2.024866 3.874492 ] [ 3.797222 3.704908 3.463102 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.430797e-10 9.143471e-11 3.003228e-10 ] [ 2.900858e-10 2.600657e-10 5.132587e-10 ] [ 1.698571e-10 3.470708e-10 2.452381e-10 ] [ 4.30988e-10 2.177249e-10 1.737833e-10 ] [ 5.127339e-10 2.024866e-10 3.874492e-10 ] [ 3.797222e-10 3.704908e-10 3.463102e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.2938106 0.9038307 0.2113448 ] [ -12.3595475 -13.3536597 20.4570563 ] [ -4.6323984 -1.1556342 -2.5051157 ] [ -4.2154349 -6.0388446 -24.1473071 ] [ 28.667127 -27.2408497 21.800285 ] [ -7.1659355 46.8851577 -15.8162633 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.707364742632204e-10 1.448096416701299e-09 3.386116974876518e-10 ] [ -1.980217804816709e-08 -2.139492137345914e-08 3.277581733424935e-08 ] [ -7.421920414711326e-09 -1.851530097436911e-09 -4.013637806939027e-09 ] [ -6.753871243284386e-09 -9.675295634764327e-09 -3.868825089089785e-08 ] [ 4.592980066490444e-08 -4.36446525200667e-08 3.492790695377693e-08 ] [ -1.148109432426076e-08 7.51183035294611e-08 -2.534044728767706e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -7.6310075 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.222622180964946e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.1049995 1.2967877 2.869409 ] [ 3.1409322 2.0550815 5.0978201 ] [ 1.2990811 3.6573822 2.3293873 ] [ 4.4379249 1.7654561 1.8937688 ] [ 5.5971162 2.1757763 4.2035416 ] [ 3.6846132 3.9422514 3.2696961 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.1049995e-10 1.2967877e-10 2.869409e-10 ] [ 3.1409322e-10 2.0550815e-10 5.0978201e-10 ] [ 1.2990811e-10 3.6573822e-10 2.3293873e-10 ] [ 4.4379249e-10 1.7654561e-10 1.8937688e-10 ] [ 5.5971162e-10 2.1757763e-10 4.2035416e-10 ] [ 3.6846132e-10 3.9422514e-10 3.2696961e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.83e-05 1.88e-05 -0.0001037 ] [ -4.08e-05 6.31e-05 8.7e-05 ] [ -0.0001128 3.8e-06 2.46e-05 ] [ 5.7e-06 -3.71e-05 -3.61e-05 ] [ 7.65e-05 -2.02e-05 2.57e-05 ] [ 3.31e-05 -2.84e-05 2.5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.136336457664001e-14 3.012092047104e-14 -1.6614571557696e-13 ] [ -6.536880612864e-14 1.0109734477248e-13 1.393893660096e-13 ] [ -1.8072552282624e-13 6.08827115904e-15 3.941354487168e-14 ] [ 9.13240673856e-15 -5.944075263168e-14 -5.783857601088001e-14 ] [ 1.225665114912e-13 -3.236396774016e-14 4.117593915456e-14 ] [ 5.303204614848e-14 -4.550181603071999e-14 4.005441552e-15 ] ] } "relaxed-potential-energy" { "source-value" -20.401793 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.26872757670011e-18 } }