{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.141713 2.790286 2.578895 ] [ 2.447264 4.204759 1.029358 ] [ 3.674509 2.140287 1.595277 ] [ 3.884686 4.035277 2.681176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.141713e-10 2.790286e-10 2.578895e-10 ] [ 2.447264e-10 4.204759e-10 1.029358e-10 ] [ 3.674509e-10 2.140287e-10 1.595277e-10 ] [ 3.884686e-10 4.035277e-10 2.681176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -14.3871359 -5.5607955 9.1169816 ] [ -4.8430991 8.5214405 -9.849116 ] [ 9.0236268 -12.1228464 -6.6896869 ] [ 10.2066081 9.1622015 7.4218212 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.305073277925237e-08 -8.909376543149847e-09 1.460701477178378e-08 ] [ -7.759500150237522e-09 1.365285274463826e-08 -1.578002339074721e-08 ] [ 1.445744389378432e-08 -1.942294107962944e-08 -1.071805995165203e-08 ] [ 1.635278887548791e-08 1.467946503835869e-08 1.18910684103978e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -1.4990698 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.401774586507332e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.6434411 2.3983256 1.9690622 ] [ 2.1619404 4.6570964 1.6328539 ] [ 3.9121536 1.9281966 2.3094342 ] [ 4.4306369 4.1869903 1.9733557 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6434411e-10 2.3983256e-10 1.9690622e-10 ] [ 2.1619404e-10 4.657096400000001e-10 1.6328539e-10 ] [ 3.9121536e-10 1.9281966e-10 2.3094342e-10 ] [ 4.4306369e-10 4.1869903e-10 1.9733557e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.16e-05 2.8e-05 -2.86e-05 ] [ 3.84e-05 -5.68e-05 4.61e-05 ] [ -5.55e-05 6.86e-05 1.35e-05 ] [ -5.45e-05 -3.97e-05 -3.11e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.1471584604928e-13 4.48609453824e-14 -4.582225135488e-14 ] [ 6.152358223872e-14 -9.100363206143999e-14 7.386034221888001e-14 ] [ -8.892080245440001e-14 1.0990931618688e-13 2.16293843808e-14 ] [ -8.731862583360001e-14 -6.360641184576e-14 -4.982769290688e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.9297943 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.43071076560131e-18 } }