{ "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" [ [ 1.30949 2.712734 2.978333 ] [ 0.0672006 1.690783 1.932827 ] [ 2.539316 0.8650755 1.245634 ] [ 2.964133 0.3086468 2.850804 ] [ 2.353048 2.858216 0.4219119 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.30949e-10 2.712734e-10 2.978333e-10 ] [ 6.72006e-12 1.690783e-10 1.932827e-10 ] [ 2.539316e-10 8.650755e-11 1.245634e-10 ] [ 2.964133e-10 3.086468e-11 2.850804e-10 ] [ 2.353048e-10 2.858216e-10 4.219119e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 6.8210345 -2.4131896 -1.2830716 ] [ -1.3704417 -2.724857 -2.4434932 ] [ -3.4386472 0.5860274 -4.1275167 ] [ -1.1620372 2.5657539 5.8196077 ] [ -0.8499084 1.9862654 2.0344738 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.092850209560787e-08 -3.866355990531806e-09 -2.055707337268994e-09 ] [ -2.195689669999238e-09 -4.365702216391338e-09 -3.914907710377888e-09 ] [ -5.509320196409524e-09 9.389194071637716e-10 -6.613010813184788e-09 ] [ -1.861788849678785e-09 4.110790947174372e-09 9.32403947598648e-09 ] [ -1.361703379520325e-09 3.182348012802663e-09 3.259586384845189e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.5683811 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.533023662362722e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7170865 2.6317967 2.8446895 ] [ -0.0579044 1.331053 1.826781 ] [ 2.1245062 0.7700297 0.9317976 ] [ 2.9242765 0.5713631 3.201333 ] [ 2.5252229 3.1312128 0.6249088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7170865e-10 2.6317967e-10 2.8446895e-10 ] [ -5.790440000000001e-12 1.331053e-10 1.826781e-10 ] [ 2.1245062e-10 7.700297e-11 9.317976e-11 ] [ 2.9242765e-10 5.713631e-11 3.201333e-10 ] [ 2.5252229e-10 3.1312128e-10 6.249088000000001e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.84e-05 -7.1e-06 1.53e-05 ] [ -7.7e-06 -6.2e-06 1.26e-05 ] [ -1.08e-05 -2.6e-06 -1.8e-06 ] [ 1e-05 1.29e-05 -1.38e-05 ] [ 3.69e-05 3.1e-06 -1.24e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.550181640559999e-14 -1.13754541014e-14 2.45133025002e-14 ] [ -1.23367600818e-14 -9.9334951308e-15 2.01874255884e-14 ] [ -1.73035076472e-14 -4.165659248399999e-15 -2.8839179412e-15 ] [ 1.602176634e-14 2.06680785786e-14 -2.21100375492e-14 ] [ 5.91203177946e-14 4.9667475654e-15 -1.98669902616e-14 ] ] } "relaxed-potential-energy" { "source-value" -15.390494 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.465828987251719e-18 } }