{ "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" [ [ 2.717363 2.851349 1.457488 ] [ 0.2108152 2.748454 1.624055 ] [ 2.409053 4.258926 3.949315 ] [ 4.77033 2.580775 2.438947 ] [ 3.623649 2.286945 4.240246 ] [ 4.139768 4.74377 1.918983 ] [ 5.145543 4.155434 3.91724 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.717363e-10 2.851349e-10 1.457488e-10 ] [ 2.108152e-11 2.748454e-10 1.624055e-10 ] [ 2.409053e-10 4.258926e-10 3.949315e-10 ] [ 4.770330000000001e-10 2.580775e-10 2.438947e-10 ] [ 3.623649e-10 2.286945e-10 4.240246e-10 ] [ 4.139768e-10 4.743769999999999e-10 1.918983e-10 ] [ 5.145543e-10 4.155434e-10 3.91724e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.8325117 -0.4782771 -1.7846579 ] [ 3.3273119 0.1115671 -0.1256631 ] [ -0.7041617 0.9887216 -1.4804794 ] [ 4.3398821 -6.4733395 -5.8528877 ] [ -2.7079865 -2.1025852 4.8955573 ] [ -2.639419 3.9860382 -0.9219433 ] [ 4.2168849 3.9678747 5.2700742 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.344713963271618e-09 -7.662843941972813e-10 -2.859337187063508e-09 ] [ 5.330941380210144e-09 1.787502007431414e-10 -2.013344825760054e-10 ] [ -1.128191422297718e-09 1.584106645051094e-09 -2.371989501798339e-09 ] [ 6.95325769493485e-09 -1.037143329084924e-08 -9.377359914366e-09 ] [ -4.33867269548744e-09 -3.368712878434217e-09 7.843547516468127e-09 ] [ -4.228815449135646e-09 6.386337266271419e-09 -1.477116013132852e-09 ] [ 6.756194455047427e-09 6.357236130979759e-09 8.443589742686243e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.447896 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.834155147966206e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.7851453 3.0620308 1.2270133 ] [ 0.7199938 2.4324582 0.4480065 ] [ 2.5061983 4.6018759 4.7014844 ] [ 4.238178 1.778784 2.6289176 ] [ 4.0547942 2.7905489 4.9120159 ] [ 3.3000308 5.0265517 2.487353 ] [ 5.4121807 3.9334036 3.1414833 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.7851453e-10 3.0620308e-10 1.2270133e-10 ] [ 7.199938e-11 2.4324582e-10 4.480065e-11 ] [ 2.5061983e-10 4.6018759e-10 4.701484400000001e-10 ] [ 4.238178e-10 1.778784e-10 2.6289176e-10 ] [ 4.0547942e-10 2.7905489e-10 4.912015900000001e-10 ] [ 3.3000308e-10 5.0265517e-10 2.487353e-10 ] [ 5.412180700000001e-10 3.9334036e-10 3.1414833e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.6e-06 -1.18e-05 1.19e-05 ] [ 2.7e-05 1.47e-05 -3.13e-05 ] [ 1.66e-05 -2.5e-05 9.6e-06 ] [ -2.78e-05 -3.81e-05 1.37e-05 ] [ 2.29e-05 2.02e-05 3.8e-05 ] [ -2.04e-05 3.57e-05 5.2e-06 ] [ -2.49e-05 4.2e-06 -4.73e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.05743657844e-14 -1.89056842812e-14 1.90659019446e-14 ] [ 4.325876911799999e-14 2.35519965198e-14 -5.014812864419999e-14 ] [ 2.65961321244e-14 -4.005441585e-14 1.53808956864e-14 ] [ -4.454051042519999e-14 -6.10429297554e-14 2.19498198858e-14 ] [ 3.66898449186e-14 3.236396800679999e-14 6.088271209199999e-14 ] [ -3.26844033336e-14 5.719770583379999e-14 8.331318496799998e-15 ] [ -3.989419818659999e-14 6.729141862799999e-15 -7.578295478819998e-14 ] ] } "relaxed-potential-energy" { "source-value" -17.172179 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.751286394866548e-18 } }