{ "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" [ [ 1.498941 0.2917441 1.412179 ] [ 0.7321813 1.344758 2.47059 ] [ 0.7391833 1.573141 0.3619984 ] [ 0.011627 2.973124 1.6693 ] [ 2.701347 1.320916 0.403113 ] [ 2.713757 1.097636 2.168947 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.498941e-10 2.917441e-11 1.412179e-10 ] [ 7.321813e-11 1.344758e-10 2.47059e-10 ] [ 7.391833000000001e-11 1.573141e-10 3.619984e-11 ] [ 1.1627e-12 2.973124e-10 1.6693e-10 ] [ 2.701347e-10 1.320916e-10 4.03113e-11 ] [ 2.713757e-10 1.097636e-10 2.168947e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.6015754 -3.592019 13.4237328 ] [ -18.1320904 -3.2074939 29.2939216 ] [ -13.0156718 -3.1834535 -22.8288161 ] [ -3.3469359 6.8475803 -1.3231063 ] [ 30.1921421 13.2485128 -10.7367981 ] [ 14.9041314 -10.1131267 -7.8289338 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.698559624952841e-08 -5.755048863269396e-09 2.150719085602612e-08 ] [ -2.905081132511212e-08 -5.138971737938613e-09 4.693403631906813e-08 ] [ -2.085340506196585e-08 -5.100454771103933e-09 -3.657579543596264e-08 ] [ -5.362382450296207e-09 1.097103306571065e-08 -2.119849980693191e-09 ] [ 4.837314420449142e-08 2.122645746852955e-08 -1.720224689806986e-08 ] [ 2.387905088241118e-08 -1.620301516192826e-08 -1.25433347001509e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 16.420552 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.630862451503069e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.2504372 -0.0373234 1.8979523 ] [ 0.136249 1.5546055 3.3458719 ] [ 0.7583773 1.4453212 -0.0324286 ] [ -0.1946668 3.1847169 1.4431635 ] [ 3.2147671 2.0714117 -0.002422 ] [ 3.2318728 0.3825872 1.8339904 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2504372e-10 -3.73234e-12 1.8979523e-10 ] [ 1.36249e-11 1.5546055e-10 3.3458719e-10 ] [ 7.583773e-11 1.4453212e-10 -3.24286e-12 ] [ -1.946668e-11 3.1847169e-10 1.4431635e-10 ] [ 3.2147671e-10 2.0714117e-10 -2.422e-13 ] [ 3.2318728e-10 3.825872e-11 1.8339904e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.55e-05 -2.48e-05 -1.49e-05 ] [ 1.94e-05 5.85e-05 -2e-06 ] [ -3.2e-06 -1.76e-05 -3.14e-05 ] [ -3.9e-05 2e-07 2.12e-05 ] [ 6.6e-06 1.17e-05 4.04e-05 ] [ -9.2e-06 -2.8e-05 -1.33e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.08555038304e-14 -3.973398019584e-14 -2.387243164992e-14 ] [ 3.108222644352e-14 9.37273323168e-14 -3.2043532416e-15 ] [ -5.126965186560001e-15 -2.819830852608e-14 -5.030834589312e-14 ] [ -6.248488821120001e-14 3.2043532416e-16 3.396614436096001e-14 ] [ 1.057436569728e-14 1.874546646336e-14 6.472793548032e-14 ] [ -1.474002491136e-14 -4.48609453824e-14 -2.130894905664e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.768929 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.366243275805512e-18 } }