{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.9136055 0.1992462 0.0711002 ] [ 0.7203108 0.3740979 2.589381 ] [ 1.027468 2.872573 2.429267 ] [ 2.566191 2.896163 0.5924317 ] [ 2.633567 2.125326 2.686178 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.136055e-11 1.992462e-11 7.11002e-12 ] [ 7.203108000000001e-11 3.740979e-11 2.589381e-10 ] [ 1.027468e-10 2.872573e-10 2.429267e-10 ] [ 2.566191e-10 2.896163e-10 5.924317e-11 ] [ 2.633567e-10 2.125326e-10 2.686178e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.13259 -0.2728526 0.1382912 ] [ -1.6516535 -1.9827383 -0.4411664 ] [ -47.7616659 19.7183048 1.4182377 ] [ 6.5880832 0.843846 -9.7208515 ] [ 42.9578262 -18.3065599 8.605489 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.12432598151872e-10 -4.371580566444941e-10 2.21566927502377e-10 ] [ -2.646240623362493e-09 -3.176696949424737e-09 -7.068264919625012e-10 ] [ -7.652262447544059e-08 3.159220695236842e-08 2.272267285677164e-09 ] [ 1.055527287892525e-08 1.351990332755597e-09 -1.557452100756861e-08 ] [ 6.88260248180297e-08 -2.933034227905478e-08 1.378751328635157e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 0.50432806 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 8.080226269454196e-20 } "relaxed-configuration-positions" { "source-value" [ [ 0.9408159 0.8501797 0.0273427 ] [ 0.9627944 0.9946107 2.506106 ] [ -0.5783474 2.7372818 3.0863111 ] [ 3.3064417 1.8893485 0.0837621 ] [ 3.2294377 1.9959855 2.6648359 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.408159000000001e-11 8.501797e-11 2.73427e-12 ] [ 9.627944e-11 9.946107e-11 2.506106e-10 ] [ -5.783474e-11 2.7372818e-10 3.0863111e-10 ] [ 3.3064417e-10 1.8893485e-10 8.37621e-12 ] [ 3.2294377e-10 1.9959855e-10 2.6648359e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 -1e-06 -7.8e-06 ] [ -4.2e-06 -3e-06 4.1e-06 ] [ 6.3e-06 1.4e-06 3.4e-06 ] [ -1.7e-06 -1.3e-06 3.5e-06 ] [ -4.9e-06 3.9e-06 -3.2e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 -1.6021766208e-15 -1.249697764224e-14 ] [ -6.72914180736e-15 -4.8065298624e-15 6.568924145279999e-15 ] [ 1.009371271104e-14 2.24304726912e-15 5.44740051072e-15 ] [ -2.72370025536e-15 -2.08282960704e-15 5.6076181728e-15 ] [ -7.850665441919999e-15 6.24848882112e-15 -5.126965186560001e-15 ] ] } "relaxed-potential-energy" { "source-value" -13.90107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.227196935810426e-18 } }