{ "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" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -3.4680448 -4.0872762 -10.1209559 ] [ -1.8726698 -3.6144114 9.6339475 ] [ -1.4837015 7.0447435 3.9923892 ] [ 6.2972019 -4.7206883 -0.1721317 ] [ 0.2425457 4.712996 -5.945422 ] [ 0.2846685 0.6646364 2.6121729 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.556420298447012e-09 -6.548538370392264e-09 -1.621555892312782e-08 ] [ -3.000347772038212e-09 -5.790925443032997e-09 1.543528545051461e-08 ] [ -2.377151855545891e-09 1.128692333523277e-08 6.396512637374416e-09 ] [ 1.008922966063734e-08 -7.563376428344097e-09 -2.757853854385594e-10 ] [ 3.886010500155705e-10 7.551052005123918e-09 -9.525616129189978e-09 ] [ 4.560892153782048e-10 1.064864901412677e-09 4.185162349867336e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.375402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.463410961980156e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5529472 0.6935272 0.5506902 ] [ 1.0166047 0.6002876 2.9719946 ] [ 0.3176468 2.7248544 1.9308068 ] [ 2.8692968 0.4165312 1.3533027 ] [ 2.1703419 2.5410957 0.3121199 ] [ 2.6339957 2.4478602 2.7334271 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.529472e-11 6.935272e-11 5.506902000000001e-11 ] [ 1.0166047e-10 6.002876e-11 2.9719946e-10 ] [ 3.176468e-11 2.7248544e-10 1.9308068e-10 ] [ 2.8692968e-10 4.165312e-11 1.3533027e-10 ] [ 2.1703419e-10 2.5410957e-10 3.121199e-11 ] [ 2.6339957e-10 2.4478602e-10 2.7334271e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -8e-07 -6.5e-06 -5.5e-06 ] [ 8.2e-06 8.2e-06 -6.5e-06 ] [ 1.13e-05 -1e-07 6.7e-06 ] [ -3.9e-06 3.5e-06 1.75e-05 ] [ -3.6e-06 9.6e-06 3.9e-06 ] [ -1.12e-05 -1.46e-05 -1.61e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.28174129664e-15 -1.04141480352e-14 -8.8119714144e-15 ] [ 1.313784829056e-14 1.313784829056e-14 -1.04141480352e-14 ] [ 1.810459581504e-14 -1.6021766208e-16 1.073458335936e-14 ] [ -6.24848882112e-15 5.6076181728e-15 2.8038090864e-14 ] [ -5.76783583488e-15 1.538089555968e-14 6.24848882112e-15 ] [ -1.794437815296e-14 -2.339177866368e-14 -2.579504359488e-14 ] ] } "relaxed-potential-energy" { "source-value" -20.568499 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.295436822274818e-18 } }