{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.512586 2.352376 3.000619 ] [ 5.747731 2.138199 1.702882 ] [ 4.441387 1.564453 3.266826 ] [ 5.259627 4.180433 2.034508 ] [ 3.39507 3.451757 1.390248 ] [ 4.402652 3.245897 4.59308 ] [ 3.137856 4.41534 3.36482 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.512586e-10 2.352376e-10 3.000619e-10 ] [ 5.747731e-10 2.138199e-10 1.702882e-10 ] [ 4.441387e-10 1.564453e-10 3.266826e-10 ] [ 5.259627e-10 4.180433e-10 2.034508e-10 ] [ 3.39507e-10 3.451757e-10 1.390248e-10 ] [ 4.402652e-10 3.245897e-10 4.59308e-10 ] [ 3.137856000000001e-10 4.41534e-10 3.36482e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.59829 -6.1732133 1.5438116 ] [ 4.7032235 -3.3767196 -4.0301085 ] [ 3.7649779 -11.7783027 3.8454299 ] [ 6.9574738 7.8025613 0.4758281 ] [ -4.4637765 0.7120637 -12.9734143 ] [ 4.5623399 1.0434861 7.6176399 ] [ -4.9259486 11.7701244 3.5208135 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.698033245845843e-08 -9.890578024471617e-09 2.473458852439841e-09 ] [ 7.535394734097149e-09 -5.410101198117128e-09 -6.456945617987357e-09 ] [ 6.03215956920868e-09 -1.887092121864552e-08 6.161057882705282e-09 ] [ 1.114710186218854e-08 1.250108129721886e-08 7.623606573396845e-10 ] [ -7.151758348776451e-09 1.140851812660345e-09 -2.07857010834124e-08 ] [ 7.30967432392301e-09 1.671849033549771e-09 1.220480455345325e-08 ] [ -7.89223968218249e-09 1.885781813758763e-08 5.640965075897021e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.12748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423689478761959e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2828742 2.3891656 3.4389539 ] [ 5.7867315 2.2479832 1.0174129 ] [ 4.6736147 1.4648395 3.1169972 ] [ 5.498321 4.0756079 2.7018096 ] [ 3.416488 3.0268378 1.2069113 ] [ 4.1975311 3.3537323 4.8138005 ] [ 3.0413485 4.7902888 3.0570976 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2828742e-10 2.3891656e-10 3.4389539e-10 ] [ 5.7867315e-10 2.2479832e-10 1.0174129e-10 ] [ 4.6736147e-10 1.4648395e-10 3.1169972e-10 ] [ 5.498321e-10 4.0756079e-10 2.7018096e-10 ] [ 3.416488e-10 3.0268378e-10 1.2069113e-10 ] [ 4.1975311e-10 3.3537323e-10 4.813800500000001e-10 ] [ 3.0413485e-10 4.7902888e-10 3.0570976e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.09e-05 4.9e-06 -3.27e-05 ] [ -4.31e-05 1.4e-05 5.48e-05 ] [ 1.01e-05 4.94e-05 -2.86e-05 ] [ -3.65e-05 -2.85e-05 -4.11e-05 ] [ 2.94e-05 -1.38e-05 6.03e-05 ] [ 1.35e-05 -5.13e-05 2.48e-05 ] [ 5.8e-06 2.53e-05 -3.75e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.348549137472e-14 7.850665441919999e-15 -5.239117550016001e-14 ] [ -6.905381235648e-14 2.24304726912e-14 8.779927881984e-14 ] [ 1.618198387008e-14 7.914752506752001e-14 -4.582225135488e-14 ] [ -5.84794466592e-14 -4.56620336928e-14 -6.584945911488e-14 ] [ 4.710399265152e-14 -2.211003736704e-14 9.661125023424001e-14 ] [ 2.16293843808e-14 -8.219166064704e-14 3.973398019584e-14 ] [ 9.292624400640001e-15 4.053506850624e-14 -6.008162327999999e-14 ] ] } "relaxed-potential-energy" { "source-value" -24.005399 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.84608890507757e-18 } }