{ "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" [ [ 2.263215 2.218791 2.823685 ] [ 2.787552 3.729015 0.8142493 ] [ 2.212325 4.309555 3.289264 ] [ 3.882235 1.940561 0.9401229 ] [ 4.958804 1.525412 3.341241 ] [ 4.281489 4.073298 2.625609 ] [ 3.697667 3.229021 4.691712 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.263215e-10 2.218791e-10 2.823685e-10 ] [ 2.787552e-10 3.729015e-10 8.142493e-11 ] [ 2.212325e-10 4.309555e-10 3.289264e-10 ] [ 3.882235e-10 1.940561e-10 9.401229e-11 ] [ 4.958804e-10 1.525412e-10 3.341241e-10 ] [ 4.281489e-10 4.073298000000001e-10 2.625609e-10 ] [ 3.697667e-10 3.229021e-10 4.691712e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.1488038 -3.2472413 -1.6335974 ] [ -3.4496826 3.1797146 -1.1616447 ] [ -6.1521267 6.5284382 -0.2266285 ] [ 1.8305985 -2.2857491 1.8302275 ] [ -2.4152392 2.6112392 -0.5649423 ] [ 4.2172144 -3.743569 -2.4453795 ] [ 1.8204318 -3.0428326 4.2019649 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.647116507410407e-09 -5.202654135819784e-09 -2.617311583643152e-09 ] [ -5.527000856436368e-09 5.094464434908655e-09 -1.86115999534994e-09 ] [ -9.856793648147527e-09 1.045971114055302e-08 -3.630988872984689e-10 ] [ 2.932942142935449e-09 -3.662173799206529e-09 2.932347735404235e-09 ] [ -3.869639811760853e-09 4.183666432024852e-09 -9.05137352618218e-10 ] [ 6.756722372248328e-09 -5.997858779566745e-09 -3.917929896162602e-09 ] [ 2.916653293750561e-09 -4.875155292893469e-09 6.732289979668146e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -14.87335006491639 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.382973394331142e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.4803024 2.2334767 2.9049506 ] [ 2.5914673 3.6014557 0.4447994 ] [ 2.156311 4.5928989 3.5034874 ] [ 4.0657556 2.0366139 1.0482636 ] [ 4.9510689 1.3621093 3.0316248 ] [ 4.3405599 3.8820663 2.6352366 ] [ 3.497822 3.3170322 4.9575208 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.4803024e-10 2.2334767e-10 2.9049506e-10 ] [ 2.5914673e-10 3.6014557e-10 4.447994e-11 ] [ 2.156311e-10 4.5928989e-10 3.5034874e-10 ] [ 4.0657556e-10 2.0366139e-10 1.0482636e-10 ] [ 4.951068900000001e-10 1.3621093e-10 3.0316248e-10 ] [ 4.3405599e-10 3.8820663e-10 2.6352366e-10 ] [ 3.497822e-10 3.3170322e-10 4.9575208e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -0.0001598 -1.49e-05 -3.6e-05 ] [ 7.79e-05 -9.18e-05 -0.0001316 ] [ 7e-07 2.06e-05 0.0001594 ] [ 2.8e-06 -3.75e-05 -5.85e-05 ] [ -2.61e-05 6.04e-05 6.79e-05 ] [ 2.73e-05 0.0001446 -6.64e-05 ] [ 7.73e-05 -8.13e-05 6.52e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.560278261132e-13 -2.38724318466e-14 -5.7678358824e-14 ] [ 1.248095597886e-13 -1.470798150012e-13 -2.108464450344e-13 ] [ 1.1215236438e-15 3.300483866039999e-14 2.553869554596e-13 ] [ 4.486094575199999e-15 -6.008162377499999e-14 -9.372733308899998e-14 ] [ -4.18168101474e-14 9.677146869359998e-14 1.087877934486e-13 ] [ 4.37394221082e-14 2.316747412764e-13 -1.063845284976e-13 ] [ 1.238482538082e-13 -1.302569603442e-13 1.044619165368e-13 ] ] } "relaxed-potential-energy" { "source-value" -18.848443064916392 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.019853506588839e-18 } }