{ "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" [ [ 0.0251564 0.6941165 0.4465085 ] [ 0.3172663 0.1337315 1.61278 ] [ 0.5869901 2.638721 0.7880578 ] [ 2.963349 2.149596 1.324349 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.51564e-12 6.941165e-11 4.465085e-11 ] [ 3.172663e-11 1.337315e-11 1.61278e-10 ] [ 5.869901e-11 2.638721e-10 7.880578e-11 ] [ 2.963349e-10 2.149596e-10 1.324349e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -19.8910812 27.2822599 -72.160162 ] [ 17.6561181 -37.1373553 71.966961 ] [ 3.5433848 9.6854486 0.3940655 ] [ -1.3084217 0.1696468 -0.2008645 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.186902526107441e-08 4.371099897436935e-08 -1.156133245095406e-07 ] [ 2.828821963390372e-08 -5.950060242000298e-08 1.153037823842254e-07 ] [ 5.677128285058085e-09 1.551779930888009e-08 6.313625311638624e-10 ] [ -2.096322657887391e-09 2.718041367535334e-10 -3.218204058486816e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 15.887716 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.545492713311009e-18 } "relaxed-configuration-positions" { "source-value" [ [ -0.4450259 0.9077938 0.2720904 ] [ 1.1033022 -0.1104547 1.7785406 ] [ 0.8430773 2.9185381 0.3073092 ] [ 2.3914082 1.9002878 1.8137551 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -4.450259e-11 9.077938e-11 2.720904e-11 ] [ 1.1033022e-10 -1.104547e-11 1.7785406e-10 ] [ 8.430773000000001e-11 2.9185381e-10 3.073092e-11 ] [ 2.3914082e-10 1.9002878e-10 1.8137551e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 3.82e-05 1.45e-05 2.21e-05 ] [ 7e-07 -1e-07 -1.3e-06 ] [ -2e-07 -9e-07 -1.6e-06 ] [ -3.86e-05 -1.35e-05 -1.92e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.120314691456e-14 2.32315610016e-14 3.540810331968e-14 ] [ 1.12152363456e-15 -1.6021766208e-16 -2.08282960704e-15 ] [ -3.2043532416e-16 -1.44195895872e-15 -2.56348259328e-15 ] [ -6.184401756288e-14 -2.16293843808e-14 -3.076179111936e-14 ] ] } "relaxed-potential-energy" { "source-value" -8.1407198 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.304287094004365e-18 } }