{ "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" [ [ 1.691051 2.220945 1.919277 ] [ 2.666072 2.808957 4.219459 ] [ 1.090931 4.286689 3.184511 ] [ 3.947256 1.730986 2.765408 ] [ 5.245402 2.932614 3.956238 ] [ 3.932067 4.011287 2.276365 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.691051e-10 2.220945e-10 1.919277e-10 ] [ 2.666072e-10 2.808957e-10 4.219459e-10 ] [ 1.090931e-10 4.286689e-10 3.184511e-10 ] [ 3.947256e-10 1.730986e-10 2.765408e-10 ] [ 5.245402000000001e-10 2.932614e-10 3.956238e-10 ] [ 3.932067e-10 4.011287e-10 2.276365e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.2878874 -8.4305217 -13.2870417 ] [ -15.4098174 -1.6269745 27.882829 ] [ -6.8882565 5.8816778 0.8776955 ] [ 5.8849364 -22.48425 -8.3492827 ] [ 19.6193114 2.8386416 9.8095489 ] [ 11.0817134 23.8214268 -16.933749 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.28917191529029e-08 -1.350718476888707e-08 -2.128818757133469e-08 ] [ -2.468924916907704e-08 -2.606700506537769e-09 4.467321674556425e-08 ] [ -1.103620352237364e-08 9.423486662238379e-09 1.406223210281366e-09 ] [ 9.428707514974918e-09 -3.60237396862224e-08 -1.33770255423899e-08 ] [ 3.143360204127492e-08 4.548005206350305e-09 1.571662990817435e-08 ] [ 1.775486212788608e-08 3.816613309305856e-08 -2.713085675029538e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 11.904367 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 1.907289849282304e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.7146957 1.9684669 1.77555 ] [ 2.6343053 3.2017703 5.0955034 ] [ 1.6537138 4.0431816 2.9571685 ] [ 3.8809205 1.1314073 2.3481106 ] [ 4.7228179 2.8572808 3.7683019 ] [ 3.9663259 4.789371 2.3766236 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.7146957e-10 1.9684669e-10 1.77555e-10 ] [ 2.6343053e-10 3.2017703e-10 5.0955034e-10 ] [ 1.6537138e-10 4.0431816e-10 2.9571685e-10 ] [ 3.8809205e-10 1.1314073e-10 2.3481106e-10 ] [ 4.7228179e-10 2.8572808e-10 3.7683019e-10 ] [ 3.9663259e-10 4.789371e-10 2.3766236e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 4.4e-06 -1.11e-05 4.6e-05 ] [ -6.1e-06 -9.7e-06 -1.1e-06 ] [ 3e-05 -6.1e-06 -9e-06 ] [ 5e-07 1.76e-05 -4.07e-05 ] [ -4.81e-05 2.05e-05 1.18e-05 ] [ 1.93e-05 -1.11e-05 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.04957713152e-15 -1.778416049088e-14 7.37001245568e-14 ] [ -9.77327738688e-15 -1.554111322176e-14 -1.76239428288e-15 ] [ 4.8065298624e-14 -9.77327738688e-15 -1.44195895872e-14 ] [ 8.010883104e-16 2.819830852608e-14 -6.520858846656e-14 ] [ -7.706469546047999e-14 3.28446207264e-14 1.890568412544e-14 ] [ 3.092200878144e-14 -1.778416049088e-14 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -13.132746 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.104097860810472e-18 } }