{ "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" [ [ 2.221555 1.50122 1.826509 ] [ 1.576881 2.934657 3.026633 ] [ 2.584327 1.716088 4.47164 ] [ 2.903501 3.607036 1.073051 ] [ 4.2877 3.061946 5.191695 ] [ 4.423391 1.863673 3.155042 ] [ 3.612063 4.220863 3.087476 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.221555e-10 1.50122e-10 1.826509e-10 ] [ 1.576881e-10 2.934657e-10 3.026633e-10 ] [ 2.584327e-10 1.716088e-10 4.47164e-10 ] [ 2.903501e-10 3.607036e-10 1.073051e-10 ] [ 4.2877e-10 3.061946e-10 5.191695e-10 ] [ 4.423391e-10 1.863673e-10 3.155042e-10 ] [ 3.612063e-10 4.220863e-10 3.087476e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.2020089 -5.5962275 -4.9487624 ] [ -7.6400058 3.4617989 1.5303776 ] [ -1.910304 -3.8639165 4.0806763 ] [ -0.2093459 1.698336 -3.9477105 ] [ 1.9975472 1.2440558 3.1967215 ] [ 6.1557942 -3.8958055 -0.1880727 ] [ 2.8083231 6.9517588 0.2767701 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.925830557573525e-09 -8.966144865178033e-09 -7.928791419174097e-09 ] [ -1.22406386755364e-08 5.546413263491157e-09 2.451935211716014e-09 ] [ -3.060644407420723e-09 -6.190676681023364e-09 6.537964164912648e-09 ] [ -3.354091066403348e-10 2.721034233462989e-09 -6.324929468786678e-09 ] [ 3.200423422784502e-09 1.993197117730641e-09 5.121712450508708e-09 ] [ 9.86266954969624e-09 -6.241768491284054e-09 -3.013256829507321e-10 ] [ 4.49942961447258e-09 1.113794542280066e-08 4.434345835564781e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -12.988955 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.081060002962327e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.6508299 1.7825956 1.6127398 ] [ 0.9354433 1.6965202 3.2394858 ] [ 2.0448141 2.4518686 5.2411969 ] [ 3.0264315 4.0781566 1.1819308 ] [ 4.252328 2.8730205 4.5024304 ] [ 4.5637642 1.1898213 2.8706224 ] [ 4.1358071 4.8335003 3.1836398 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.6508299e-10 1.7825956e-10 1.6127398e-10 ] [ 9.354433e-11 1.6965202e-10 3.2394858e-10 ] [ 2.0448141e-10 2.4518686e-10 5.2411969e-10 ] [ 3.0264315e-10 4.0781566e-10 1.1819308e-10 ] [ 4.252328000000001e-10 2.8730205e-10 4.5024304e-10 ] [ 4.5637642e-10 1.1898213e-10 2.8706224e-10 ] [ 4.1358071e-10 4.8335003e-10 3.1836398e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.24e-05 -3.5e-06 -7.1e-06 ] [ -3.2e-06 1.54e-05 1.14e-05 ] [ -2.07e-05 6.3e-06 1.01e-05 ] [ -5.6e-06 -5.3e-06 -3.8e-06 ] [ 1.23e-05 2.4e-06 1.28e-05 ] [ 8.2e-06 -1.78e-05 -2.72e-05 ] [ -1.34e-05 2.4e-06 3.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.588875630592e-14 -5.6076181728e-15 -1.137545400768e-14 ] [ -5.126965186560001e-15 2.467351996032e-14 1.826481347712e-14 ] [ -3.316505605055999e-14 1.009371271104e-14 1.618198387008e-14 ] [ -8.972189076479999e-15 -8.491536090240001e-15 -6.08827115904e-15 ] [ 1.970677243584e-14 3.84522388992e-15 2.050786074624e-14 ] [ 1.313784829056e-14 -2.851874385024e-14 -4.357920408576e-14 ] [ -2.146916671872e-14 3.84522388992e-15 6.08827115904e-15 ] ] } "relaxed-potential-energy" { "source-value" -21.442861 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.435525057726411e-18 } }