{ "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" [ [ 0.9398812 2.717033 1.670565 ] [ 2.278193 2.647912 4.038221 ] [ 1.856764 5.001969 2.684043 ] [ 3.35912 1.891848 2.112837 ] [ 5.060666 2.631323 3.812603 ] [ 4.070835 4.158298 1.920429 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.398812e-11 2.717033e-10 1.670565e-10 ] [ 2.278193e-10 2.647912e-10 4.038221e-10 ] [ 1.856764e-10 5.001969e-10 2.684043e-10 ] [ 3.35912e-10 1.891848e-10 2.112837e-10 ] [ 5.060666e-10 2.631323e-10 3.812603e-10 ] [ 4.070835e-10 4.158298e-10 1.920429e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3133262 0.8501404 1.1575795 ] [ -0.2984534 0.9464961 -0.1868331 ] [ 0.325692 -1.8415988 -0.2192872 ] [ 0.1572031 -0.5135146 -0.6119294 ] [ -1.3553865 0.4663689 -0.8865412 ] [ -0.1423813 0.0921079 0.7470115 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.104180533124105e-09 1.36207507327756e-09 1.854646811617354e-09 ] [ -4.781750598782707e-10 1.516453923098379e-09 -2.993396248115885e-10 ] [ 5.218161079815936e-10 -2.950566542253335e-09 -3.513368250806938e-10 ] [ 2.518671315372845e-10 -8.227410865594637e-10 -9.804189782601714e-10 ] [ -2.171568562447939e-09 7.47205348248213e-10 -1.420395584015977e-09 ] [ -2.28119990099111e-10 1.475731239709843e-10 1.196844360768739e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -5.187021279081939 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -8.310524224937196e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.1271951 2.670604 1.9789965 ] [ 2.201676 2.8038548 4.05755 ] [ 2.0040463 4.7341933 2.7038252 ] [ 3.4255818 1.9409674 1.8580886 ] [ 4.5928581 2.727646 3.7319286 ] [ 4.2141018 4.1711174 1.9083091 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1271951e-10 2.670604e-10 1.9789965e-10 ] [ 2.201676e-10 2.8038548e-10 4.05755e-10 ] [ 2.0040463e-10 4.7341933e-10 2.7038252e-10 ] [ 3.4255818e-10 1.9409674e-10 1.8580886e-10 ] [ 4.5928581e-10 2.727646e-10 3.7319286e-10 ] [ 4.2141018e-10 4.1711174e-10 1.9083091e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.38e-05 3.4e-06 -4.8e-06 ] [ 1.78e-05 4.67e-05 9e-06 ] [ 3.2e-06 -1.79e-05 2.09e-05 ] [ 4.53e-05 5.23e-05 -4.3e-06 ] [ -5.86e-05 3.4e-06 -5.09e-05 ] [ -5.15e-05 -8.79e-05 3.02e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.017533599104001e-14 5.44740051072e-15 -7.69044777984e-15 ] [ 2.851874385024e-14 7.482164819136e-14 1.44195895872e-14 ] [ 5.126965186560001e-15 -2.867896151232001e-14 3.348549137472e-14 ] [ 7.257860092224001e-14 8.379383726784e-14 -6.889359469440001e-15 ] [ -9.388754997888e-14 5.44740051072e-15 -8.155078999872e-14 ] [ -8.25120959712e-14 -1.4083132496832e-13 4.838573394816e-14 ] ] } "relaxed-potential-energy" { "source-value" -6.6065442790819375 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.058485078822507e-18 } }