{ "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" [ [ 1.175063 2.090387 1.108777 ] [ 2.290473 2.943113 3.7458 ] [ 1.562387 4.346014 1.227002 ] [ 3.205072 1.346551 2.036178 ] [ 4.414518 1.768723 4.119804 ] [ 3.44377 3.554925 2.238453 ] [ 4.008705 3.851776 5.027783 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.175063e-10 2.090387e-10 1.108777e-10 ] [ 2.290473e-10 2.943113e-10 3.7458e-10 ] [ 1.562387e-10 4.346014000000001e-10 1.227002e-10 ] [ 3.205072e-10 1.346551e-10 2.036178e-10 ] [ 4.414518e-10 1.768723e-10 4.119804e-10 ] [ 3.44377e-10 3.554925e-10 2.238453e-10 ] [ 4.008705e-10 3.851776e-10 5.027783000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.846611 -4.3744155 -5.4400666 ] [ -10.7098566 2.1260433 12.0419508 ] [ -2.3240626 3.7932962 -3.3784273 ] [ 1.8039434 -9.3236952 -6.1518575 ] [ 8.2360318 -8.4018072 6.310218 ] [ 7.3628062 11.9741654 -9.7165921 ] [ 2.4777489 4.2064129 6.3347747 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.096948007591211e-08 -7.008586243765142e-09 -8.715947522114947e-09 ] [ -1.715908185664058e-08 3.406296870068481e-09 1.929333204058386e-08 ] [ -3.723558762995662e-09 6.077530487409481e-09 -5.412837235132468e-09 ] [ 2.890235940726463e-09 -1.493820646890518e-08 -9.856362260993137e-09 ] [ 1.319557759812534e-08 -1.346117906830911e-08 1.011008375175134e-08 ] [ 1.179651595712129e-08 1.918472785747228e-08 -1.556769669646998e-08 ] [ 3.969791359792917e-09 6.739416405811528e-09 1.014942792237533e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 1.696307 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.717783417099386e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.2571628 2.1290149 2.0167595 ] [ 1.3186022 2.9804656 4.2596178 ] [ 1.8056291 4.289132 1.0442121 ] [ 3.633781 1.4732868 1.774777 ] [ 4.4185089 1.3544271 4.0716554 ] [ 4.0411156 4.0419037 1.964556 ] [ 3.6251885 3.6332588 4.3722192 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.2571628e-10 2.1290149e-10 2.0167595e-10 ] [ 1.3186022e-10 2.9804656e-10 4.2596178e-10 ] [ 1.8056291e-10 4.289132000000001e-10 1.0442121e-10 ] [ 3.633781e-10 1.4732868e-10 1.774777e-10 ] [ 4.4185089e-10 1.3544271e-10 4.0716554e-10 ] [ 4.0411156e-10 4.0419037e-10 1.964556e-10 ] [ 3.625188500000001e-10 3.6332588e-10 4.3722192e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.8e-06 -7.9e-06 -1.78e-05 ] [ -9.9e-06 7e-07 1.23e-05 ] [ -9e-07 -5.7e-06 -1.11e-05 ] [ -7.2e-06 5.4e-06 8.6e-06 ] [ 1.3e-06 -1.4e-06 -1.13e-05 ] [ 4.5e-06 3.1e-06 -4.8e-06 ] [ 1.71e-05 5.9e-06 2.39e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.69044777984e-15 -1.265719530432e-14 -2.851874385024e-14 ] [ -1.586154854592e-14 1.12152363456e-15 1.970677243584e-14 ] [ -1.44195895872e-15 -9.13240673856e-15 -1.778416049088e-14 ] [ -1.153567166976e-14 8.65175375232e-15 1.377871893888e-14 ] [ 2.08282960704e-15 -2.24304726912e-15 -1.810459581504e-14 ] [ 7.2097947936e-15 4.96674752448e-15 -7.69044777984e-15 ] [ 2.739722021568e-14 9.45284206272e-15 3.829202123712e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.129296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.783109785716296e-18 } }