{ "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" [ [ 0.0964554 0.9453783 1.033805 ] [ 0.3537174 0.7305408 2.827753 ] [ 0.9097692 2.353277 1.204642 ] [ 0.0320969 2.73021 2.755149 ] [ 2.067566 0.358515 1.282199 ] [ 2.580778 1.703479 2.85822 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.64554e-12 9.453783e-11 1.033805e-10 ] [ 3.537174000000001e-11 7.305408e-11 2.827753e-10 ] [ 9.097692e-11 2.353277e-10 1.204642e-10 ] [ 3.20969e-12 2.73021e-10 2.755149e-10 ] [ 2.067566e-10 3.58515e-11 1.282199e-10 ] [ 2.580778e-10 1.703479e-10 2.85822e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.7292372 -23.6748043 4.6125631 ] [ -17.6291401 -8.411157 7.4195163 ] [ 11.1363195 26.1878 -7.7479956 ] [ -5.304068 10.7354658 6.5001739 ] [ 8.4399978 -7.7775438 -15.1473483 ] [ 7.086128 2.9402392 4.3630905 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.974896704483584e-09 -3.793121826398273e-08 7.390140821670604e-09 ] [ -2.824499634573242e-08 -1.347615921030554e-08 1.188737565144213e-08 ] [ 1.784235089165856e-08 4.19574812558652e-08 -1.241365751065481e-08 ] [ -8.498053814747112e-09 1.720011245986612e-08 1.041442673951665e-08 ] [ 1.35223672661714e-08 -1.246099894627157e-08 -2.426872751331962e-08 ] [ 1.135322870713315e-08 4.710782544610852e-09 6.990441651127376e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 0.93235378 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.493795440937577e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.1804727 0.5662044 0.845065 ] [ 0.1784001 0.7940381 3.3529778 ] [ 0.9093621 2.9572521 1.3574099 ] [ -0.3760874 3.2132723 2.8036346 ] [ 2.6402486 -0.2400422 0.8595594 ] [ 2.5079868 1.5306755 2.7431214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.804727e-11 5.662044000000001e-11 8.45065e-11 ] [ 1.784001e-11 7.940381e-11 3.3529778e-10 ] [ 9.093621e-11 2.9572521e-10 1.3574099e-10 ] [ -3.760874e-11 3.2132723e-10 2.8036346e-10 ] [ 2.6402486e-10 -2.400422e-11 8.595594e-11 ] [ 2.5079868e-10 1.5306755e-10 2.7431214e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.1e-05 -2.22e-05 7.3e-06 ] [ 1.33e-05 -4.44e-05 1.31e-05 ] [ -3.97e-05 1.68e-05 6.63e-05 ] [ 4.8e-05 3.13e-05 -9.3e-05 ] [ -4.1e-06 2.93e-05 -9.7e-06 ] [ 3.6e-06 -1.07e-05 1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.364570931399999e-14 -3.55683212748e-14 1.16958894282e-14 ] [ 2.13089492322e-14 -7.11366425496e-14 2.09885139054e-14 ] [ -6.36064123698e-14 2.691656745119999e-14 1.062243108342e-13 ] [ 7.690447843199999e-14 5.014812864419999e-14 -1.49002426962e-13 ] [ -6.568924199399999e-15 4.69437753762e-14 -1.55411133498e-14 ] [ 5.767835882399999e-15 -1.71432899838e-14 2.579504380739999e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.90988 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.388826135174392e-18 } }