{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.6301007e-10 3.0172405e-10 1.1286331e-10 ] [ 1.0045763e-10 1.6188107e-10 3.6020096e-10 ] [ 1.6834681e-10 3.7503931e-10 3.0615525e-10 ] [ 4.234895e-10 1.642951e-10 1.9670727e-10 ] [ 3.210895e-10 1.1031645e-10 4.0002817e-10 ] [ 5.287607300000001e-10 3.3979243e-10 3.0190276e-10 ] [ 3.5170825e-10 3.4739058e-10 4.4872459e-10 ] ] "source-value" [ [ 2.6301007 3.0172405 1.1286331 ] [ 1.0045763 1.6188107 3.6020096 ] [ 1.6834681 3.7503931 3.0615525 ] [ 4.234895 1.642951 1.9670727 ] [ 3.210895 1.1031645 4.0002817 ] [ 5.2876073 3.3979243 3.0190276 ] [ 3.5170825 3.4739058 4.4872459 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.1301695398016e-13 4.33693189484352e-12 1.10806535094528e-12 ] [ -3.14795662454784e-12 1.1239268994912e-12 -4.70302925269632e-12 ] [ -2.95473412407936e-12 -5.88271189859136e-12 3.3998187893376e-13 ] [ -1.21989727907712e-12 -3.43410536902272e-12 6.092276600592e-12 ] [ 2.24881510495488e-12 1.5957679143168e-13 -1.51662038924928e-12 ] [ -6.324431992945921e-12 5.863966432128001e-13 2.78987014979904e-12 ] [ 1.191122186967552e-11 3.1098248209728e-12 -4.11054433832448e-12 ] ] "source-value" [ [ -0.0003202 0.0027069 0.0006916 ] [ -0.0019648 0.0007015 -0.0029354 ] [ -0.0018442 -0.0036717 0.0002122 ] [ -0.0007614 -0.0021434 0.0038025 ] [ 0.0014036 9.96e-05 -0.0009466 ] [ -0.0039474 0.000366 0.0017413 ] [ 0.0074344 0.001941 -0.0025656 ] ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -2.281426608982953e-18 "source-value" -14.239545 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -5.209766635628916e-09 2.999025495673065e-09 -1.472540729274247e-08 ] [ -5.597590149330413e-09 -2.407987186572146e-09 2.001239243278747e-09 ] [ -6.574691340244231e-09 7.121102301314063e-09 2.820787832703604e-09 ] [ 3.929723005336316e-09 -4.685536047479777e-09 -4.047961396904087e-09 ] [ 1.710080011857638e-09 -1.003796080986005e-08 9.716361344167377e-09 ] [ 1.220975015224634e-08 5.389927230978663e-09 1.819089385436615e-09 ] [ -4.675050442367289e-10 1.621429176163843e-09 2.415890723842552e-09 ] ] "source-value" [ [ -3.2516806 1.8718445 -9.1908764 ] [ -3.493741 -1.5029474 1.2490753 ] [ -4.1035996 4.4446425 1.7605973 ] [ 2.4527402 -2.9244816 -2.5265388 ] [ 1.067348 -6.2652024 6.0644758 ] [ 7.6207267 3.364128 1.1353863 ] [ -0.2917937 1.0120165 1.5078804 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.377197890227162e-18 "source-value" -8.5957932 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.682391e-10 2.686577e-10 1.562325e-10 ] [ 1.212844e-10 1.781832e-10 3.455784e-10 ] [ 1.883235e-10 4.08794e-10 3.099932e-10 ] [ 4.668223000000001e-10 1.307552e-10 1.415877e-10 ] [ 3.293332e-10 1.297731e-10 3.803317e-10 ] [ 4.485506e-10 3.146522e-10 2.925064e-10 ] [ 3.343094e-10 3.696236e-10 5.003524e-10 ] ] "source-value" [ [ 2.682391 2.686577 1.562325 ] [ 1.212844 1.781832 3.455784 ] [ 1.883235 4.08794 3.099932 ] [ 4.668223 1.307552 1.415877 ] [ 3.293332 1.297731 3.803317 ] [ 4.485506 3.146522 2.925064 ] [ 3.343094 3.696236 5.003524 ] ] } "instance-id" 1 }