{ "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" [ [ 2.649462 0.9916265 2.612716 ] [ 1.648491 2.667782 3.780456 ] [ 2.525478 3.798893 2.25676 ] [ 4.349928 2.588165 2.084291 ] [ 3.878534 1.770814 4.034173 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.649462e-10 9.916265e-11 2.612716e-10 ] [ 1.648491e-10 2.667782e-10 3.780456e-10 ] [ 2.525478e-10 3.798893e-10 2.25676e-10 ] [ 4.349928e-10 2.588165e-10 2.084291e-10 ] [ 3.878534e-10 1.770814e-10 4.034173e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -10.565579 -32.3930042 -9.0054684 ] [ -23.8398215 6.2357392 14.147154 ] [ -8.5382587 30.3762738 -14.7248438 ] [ 22.8135369 7.1550463 -16.300068 ] [ 20.1301223 -11.3740552 25.8832262 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.692792365901544e-08 -5.189931400671621e-08 -1.442835092983318e-08 ] [ -3.819560465134519e-08 9.990755559646096e-09 2.26662393896572e-08 ] [ -1.36797984714822e-08 4.866815570937957e-08 -2.359180048129183e-08 ] [ 3.65513154589381e-08 1.146364790260154e-08 -2.611558786705022e-08 ] [ 3.225201132290473e-08 -1.822324532512867e-08 4.146949988851802e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 12.682317 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.031931179497439e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.2320062 0.6854259 3.7162022 ] [ 1.021849 2.5760617 3.013958 ] [ 2.5597715 4.172879 2.2283997 ] [ 4.7204169 3.2691363 2.4451549 ] [ 4.5178493 1.1137775 3.3646812 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.2320062e-10 6.854259000000001e-11 3.7162022e-10 ] [ 1.021849e-10 2.5760617e-10 3.013958e-10 ] [ 2.5597715e-10 4.172879e-10 2.2283997e-10 ] [ 4.7204169e-10 3.2691363e-10 2.4451549e-10 ] [ 4.5178493e-10 1.1137775e-10 3.3646812e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.9e-06 1.23e-05 -3.8e-06 ] [ 1.01e-05 9e-07 -2.3e-06 ] [ -1.82e-05 -8.1e-06 5e-06 ] [ 1.13e-05 -1.73e-05 7.3e-06 ] [ -8e-06 1.23e-05 -6.1e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.850665441919999e-15 1.970677243584e-14 -6.08827115904e-15 ] [ 1.618198387008e-14 1.44195895872e-15 -3.68500622784e-15 ] [ -2.915961449856e-14 -1.297763062848e-14 8.010883104e-15 ] [ 1.810459581504e-14 -2.771765553984e-14 1.169588933184e-14 ] [ -1.28174129664e-14 1.970677243584e-14 -9.77327738688e-15 ] ] } "relaxed-potential-energy" { "source-value" -11.566682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.853186748062819e-18 } }