{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8670835 0.0748596 0.0624467 ] [ 1.077368 0.92169 1.864842 ] [ 2.976718 2.979813 0.7013645 ] [ 1.541867 2.360612 1.695051 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.670835000000001e-11 7.48596e-12 6.24467e-12 ] [ 1.077368e-10 9.216900000000001e-11 1.864842e-10 ] [ 2.976718e-10 2.979813e-10 7.013645e-11 ] [ 1.541867e-10 2.360612e-10 1.695051e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.4235486 -2.129551 -4.6875523 ] [ -5.2310236 -14.7063856 6.8166742 ] [ 8.8660293 3.9843364 -6.2748617 ] [ -3.2114571 12.8516003 4.1457398 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -6.785996702834123e-10 -3.411916853111334e-09 -7.510286765712958e-09 ] [ -8.381023783822562e-09 -2.356222737891407e-08 1.092151612483064e-08 ] [ 1.420494498081937e-08 6.383610682075677e-09 -1.005343679732152e-08 ] [ -5.145321526713401e-09 2.059053371016739e-08 6.642207438203834e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 3.8043803629049204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 6.095289324294703e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.096548 0.9454294 -0.0982117 ] [ 1.6651828 0.6336308 2.1588493 ] [ 2.9404062 2.077004 0.8152941 ] [ 0.7608994 2.6809104 1.4477724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.096548e-10 9.454294e-11 -9.82117e-12 ] [ 1.6651828e-10 6.336308000000001e-11 2.1588493e-10 ] [ 2.9404062e-10 2.077004e-10 8.152941000000001e-11 ] [ 7.608994e-11 2.6809104e-10 1.4477724e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.98e-05 -7.65e-05 -7.06e-05 ] [ -1.55e-05 -8.89e-05 5.87e-05 ] [ 4.7e-05 6.59e-05 -1.82e-05 ] [ -1.18e-05 9.94e-05 3.01e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.17230973532e-14 -1.22566512501e-13 -1.131136703604e-13 ] [ -2.4833737827e-14 -1.424335027626e-13 9.404776841579999e-14 ] [ 7.530230179799998e-14 1.055834401806e-13 -2.915961473879999e-14 ] [ -1.89056842812e-14 1.592563574196e-13 4.82255166834e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.91133903709508 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.42775391828858e-18 } }