{ "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" [ [ 2.146488 0.2959799 2.352543 ] [ 2.393537 2.53814 1.109639 ] [ 1.99319 1.640865 4.12466 ] [ 3.097066 3.51077 3.500726 ] [ 3.970578 1.750203 2.795194 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.146488e-10 2.959799e-11 2.352543e-10 ] [ 2.393537e-10 2.53814e-10 1.109639e-10 ] [ 1.99319e-10 1.640865e-10 4.12466e-10 ] [ 3.097066e-10 3.51077e-10 3.500726e-10 ] [ 3.970578e-10 1.750203e-10 2.795194e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0583895 0.1763653 -1.1263911 ] [ 0.3891491 -0.3853785 0.7732675 ] [ -0.6775319 -0.2201716 1.5868088 ] [ -1.1548886 2.814937 0.1084958 ] [ 1.3848819 -2.3857523 -1.342181 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.355029257094299e-11 2.825683627084002e-10 -1.804677501165557e-09 ] [ 6.234855951621294e-10 -6.17444427945969e-10 1.238911120331595e-09 ] [ -1.085525778969624e-09 -3.527537929903944e-10 2.542347981985579e-09 ] [ -1.850335529792972e-09 4.510026287582057e-09 1.738294356471372e-10 ] [ 2.218825421029524e-09 -3.822396589571758e-09 -2.150411036798754e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.522535 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.006331297544719e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9910857 0.4784776 2.2238147 ] [ 2.5996816 2.5396254 1.1552208 ] [ 2.1901228 1.5327945 4.3707742 ] [ 2.7987522 3.5939302 3.3021773 ] [ 4.0212166 1.5911301 2.830775 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9910857e-10 4.784776e-11 2.2238147e-10 ] [ 2.5996816e-10 2.5396254e-10 1.1552208e-10 ] [ 2.1901228e-10 1.5327945e-10 4.3707742e-10 ] [ 2.7987522e-10 3.5939302e-10 3.3021773e-10 ] [ 4.0212166e-10 1.5911301e-10 2.830775e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.6e-06 4.47e-05 3.03e-05 ] [ 1.58e-05 -2.25e-05 4.94e-05 ] [ 3.73e-05 5e-07 -7.73e-05 ] [ -1.17e-05 -3.86e-05 -1.22e-05 ] [ -4.3e-05 1.59e-05 9.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.5634826144e-15 7.16172955398e-14 4.854595201019999e-14 ] [ 2.53143908172e-14 -3.6048974265e-14 7.91475257196e-14 ] [ 5.97611884482e-14 8.010883169999999e-16 -1.238482538082e-13 ] [ -1.87454666178e-14 -6.18440180724e-14 -1.95465549348e-14 ] [ -6.889359526199999e-14 2.54746084806e-14 1.55411133498e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.3401 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.13731965152234e-18 } }