{ "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" [ [ 0.0450915 0.6744384 2.108849 ] [ 0.1091138 2.224666 0.3426204 ] [ 1.10319 2.788623 2.698849 ] [ 2.780637 1.123883 1.270131 ] [ 2.821139 0.9081744 2.973557 ] [ 2.438974 2.484533 0.05951 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.50915e-12 6.744384e-11 2.108849e-10 ] [ 1.091138e-11 2.224666e-10 3.426204e-11 ] [ 1.10319e-10 2.788623e-10 2.698849e-10 ] [ 2.780637e-10 1.123883e-10 1.270131e-10 ] [ 2.821139e-10 9.081744000000001e-11 2.973557e-10 ] [ 2.438974e-10 2.484533e-10 5.951e-12 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7141383 0.1137129 0.1659579 ] [ 0.0425795 0.2717175 0.3350754 ] [ 0.1134721 -0.5929457 -0.5719037 ] [ 1.0765988 -4.3705264 -3.6430723 ] [ -0.5918828 -0.5091852 7.8823592 ] [ -1.3549058 5.0872269 -4.1684164 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.144175688277857e-09 1.821881498633683e-10 2.658938674170643e-10 ] [ 6.821987942535359e-11 4.35339425962224e-10 5.368499720852084e-10 ] [ 1.818023457330797e-10 -9.500037379438905e-10 -9.162907374890171e-10 ] [ 1.724901427341335e-09 -7.00235521866919e-09 -5.836845266944084e-09 ] [ -9.483007844136423e-10 -8.158046230973722e-10 1.262893162698779e-08 ] [ -2.170798396146321e-09 8.15063600388486e-09 -6.678539301839301e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.275108 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.447342091779505e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5636097 0.1803099 1.7093376 ] [ -0.0209955 2.297771 0.8839572 ] [ 1.5379277 3.3194788 2.4010361 ] [ 2.8397661 0.5436133 1.0290586 ] [ 2.1226438 1.2020082 3.2263101 ] [ 2.2551935 2.6611366 0.2038168 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.636097e-11 1.803099e-11 1.7093376e-10 ] [ -2.09955e-12 2.297771e-10 8.839572e-11 ] [ 1.5379277e-10 3.3194788e-10 2.4010361e-10 ] [ 2.8397661e-10 5.436133e-11 1.0290586e-10 ] [ 2.1226438e-10 1.2020082e-10 3.2263101e-10 ] [ 2.2551935e-10 2.6611366e-10 2.038168e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.9e-06 4.4e-06 -1.43e-05 ] [ -5.9e-06 -2e-07 1.17e-05 ] [ 1.45e-05 6.1e-06 -2.8e-06 ] [ 1.26e-05 6.3e-06 1.24e-05 ] [ -1.25e-05 -9.1e-06 3.9e-06 ] [ -1.26e-05 -7.5e-06 -1.08e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.24848882112e-15 7.04957713152e-15 -2.291112567744e-14 ] [ -9.45284206272e-15 -3.2043532416e-16 1.874546646336e-14 ] [ 2.32315610016e-14 9.77327738688e-15 -4.48609453824e-15 ] [ 2.018742542208e-14 1.009371271104e-14 1.986699009792e-14 ] [ -2.002720776e-14 -1.457980724928e-14 6.24848882112e-15 ] [ -2.018742542208e-14 -1.2016324656e-14 -1.730350750464e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.411418 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.27026967169763e-18 } }