{ "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" [ [ 0.5419945 1.059703 1.497036 ] [ 0.5287309 2.297187 0.1799033 ] [ 1.173246 2.181689 2.79912 ] [ 2.288869 1.000101 0.1162968 ] [ 2.25753 0.9328521 1.885741 ] [ 2.965412 2.910996 0.3877363 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.419945000000001e-11 1.059703e-10 1.497036e-10 ] [ 5.287309e-11 2.297187e-10 1.799033e-11 ] [ 1.173246e-10 2.181689e-10 2.79912e-10 ] [ 2.288869e-10 1.000101e-10 1.162968e-11 ] [ 2.25753e-10 9.328521e-11 1.885741e-10 ] [ 2.965412e-10 2.910996e-10 3.877363e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.7504237 -6.6603572 0.8138841 ] [ -7.2329201 6.2900445 -6.4223533 ] [ -1.9532556 8.3269221 9.6097778 ] [ 5.9367662 -6.4813844 -11.2933746 ] [ 12.7143779 -9.0416229 8.8004881 ] [ 5.2854552 7.566398 -1.5084221 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.363278419373982e-08 -1.067106867993366e-08 1.303986087804119e-09 ] [ -1.158841557980894e-08 1.007776232472021e-08 -1.028974439255279e-08 ] [ -3.12946048254965e-09 1.334120002175821e-08 1.539656144909192e-08 ] [ 9.51174808716097e-09 -1.038432264165211e-08 -1.809398090312909e-08 ] [ 2.037067918722599e-08 -1.448627694381932e-08 1.409993640161506e-08 ] [ 8.468232821493797e-09 1.212270607914433e-08 -2.416758642829211e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -2.8497205 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.565755598530797e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.3343441 0.5386483 1.4983059 ] [ 0.4753797 2.6829419 0.1529614 ] [ 1.1550306 2.6718579 2.5954578 ] [ 2.0968955 0.7889702 -0.3068413 ] [ 2.7765543 0.7779104 2.1356517 ] [ 2.9175783 2.9221993 0.790298 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.343441e-11 5.386483e-11 1.4983059e-10 ] [ 4.753797e-11 2.6829419e-10 1.529614e-11 ] [ 1.1550306e-10 2.6718579e-10 2.5954578e-10 ] [ 2.0968955e-10 7.889701999999999e-11 -3.068413e-11 ] [ 2.7765543e-10 7.779104e-11 2.1356517e-10 ] [ 2.9175783e-10 2.9221993e-10 7.90298e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001186 -6.52e-05 6.94e-05 ] [ -0.0001465 2.6e-05 -0.0001094 ] [ -8.45e-05 9.38e-05 0.000118 ] [ 8.18e-05 7.12e-05 -7.61e-05 ] [ 0.000125 -0.0001057 5e-05 ] [ 0.0001428 -2e-05 -5.2e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.900181487924e-13 -1.044619165368e-13 1.111910583996e-13 ] [ -2.34718876881e-13 4.165659248399999e-14 -1.752781237596e-13 ] [ -1.35383925573e-13 1.502841682692e-13 1.89056842812e-13 ] [ 1.310580486612e-13 1.140749763408e-13 -1.219256418474e-13 ] [ 2.0027207925e-13 -1.693500702138e-13 8.010883169999999e-14 ] [ 2.287908233352e-13 -3.204353268e-14 -8.331318496799998e-14 ] ] } "relaxed-potential-energy" { "source-value" -21.869792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.503926973284012e-18 } }