{ "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" [ [ 1.222424 2.904477 0.9358623 ] [ 1.494107 1.000567 2.599919 ] [ 2.753047 4.765039 1.902757 ] [ 2.502796 3.18307 3.733295 ] [ 3.53967 2.110225 1.931082 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.222424e-10 2.904477e-10 9.358623e-11 ] [ 1.494107e-10 1.000567e-10 2.599919e-10 ] [ 2.753047e-10 4.765039e-10 1.902757e-10 ] [ 2.502796e-10 3.18307e-10 3.733295e-10 ] [ 3.53967e-10 2.110225e-10 1.931082e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.034821 2.2421448 -12.2097638 ] [ -6.2458942 -8.9184426 1.5189674 ] [ -0.6005935 9.5566323 -1.5889118 ] [ 2.2483546 5.5473151 15.9685413 ] [ 14.6329542 -8.4276495 -3.6888331 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.607755560011288e-08 3.592311979008292e-09 -1.956219810585017e-08 ] [ -1.000702566323032e-08 -1.428892022766677e-08 2.433654056037362e-09 ] [ -9.622568643044449e-10 1.531141284464213e-08 -2.545717338473245e-09 ] [ 3.602261175388135e-09 8.887778561430813e-09 2.558442353913924e-08 ] [ 2.344457711247717e-08 -1.350258299719681e-08 -5.910162150853189e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -1.146119 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.836285066454675e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.7907899 3.0960959 0.9454245 ] [ 1.7373904 1.0148571 1.4972573 ] [ 1.9331781 4.7580156 2.1558375 ] [ 3.5858036 3.7038981 3.4557577 ] [ 3.4648821 1.3905113 3.0486383 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.907899000000001e-11 3.0960959e-10 9.454245000000001e-11 ] [ 1.7373904e-10 1.0148571e-10 1.4972573e-10 ] [ 1.9331781e-10 4.758015600000001e-10 2.1558375e-10 ] [ 3.5858036e-10 3.7038981e-10 3.4557577e-10 ] [ 3.4648821e-10 1.3905113e-10 3.0486383e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.1e-06 4e-07 2.2e-06 ] [ 4.6e-06 9e-07 -5.9e-06 ] [ -2.7e-06 -9e-07 2.5e-06 ] [ 4.9e-06 4e-07 -6.8e-06 ] [ -5.7e-06 -9e-07 8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.76239428288e-15 6.408706483200001e-16 3.52478856576e-15 ] [ 7.370012455680001e-15 1.44195895872e-15 -9.45284206272e-15 ] [ -4.32587687616e-15 -1.44195895872e-15 4.005441552e-15 ] [ 7.850665441919999e-15 6.408706483200001e-16 -1.089480102144e-14 ] [ -9.13240673856e-15 -1.44195895872e-15 1.28174129664e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }