{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.305811 2.49596 1.153083 ] [ 2.737889 0.6120376 2.536176 ] [ 2.287817 4.454983 1.771215 ] [ 3.462438 1.614504 0.7986264 ] [ 3.194185 2.806829 3.238803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.305811e-10 2.49596e-10 1.153083e-10 ] [ 2.737889e-10 6.120375999999999e-11 2.536176e-10 ] [ 2.287817e-10 4.454983e-10 1.771215e-10 ] [ 3.462438e-10 1.614504e-10 7.986264e-11 ] [ 3.194185e-10 2.806829e-10 3.238803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1508469 -0.8024281 0.0629552 ] [ -1.0614631 -0.8195265 1.5210458 ] [ 0.353047 0.2624653 0.2706683 ] [ 0.8255435 1.2033519 -1.5429733 ] [ 0.0337195 0.1561373 -0.3116961 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.416833765001556e-10 -1.285631541692965e-09 1.008653495977882e-10 ] [ -1.700651362661893e-09 -1.313026198426051e-09 2.436984019926032e-09 ] [ 5.656436494435777e-10 4.205157674312583e-10 4.336584222516806e-10 ] [ 1.322666495153405e-09 1.92798228077526e-09 -2.472115747778625e-09 ] [ 5.40245945650656e-11 2.501595316948359e-10 -4.993922042145389e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -15.374315 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.463236805381475e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.1004386 2.1786385 1.0714322 ] [ 2.3568693 0.8352833 2.5913517 ] [ 2.3612107 4.0963874 1.7241781 ] [ 3.5519957 2.1209662 0.8668259 ] [ 3.6176257 2.7530382 3.2441155 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.1004386e-10 2.1786385e-10 1.0714322e-10 ] [ 2.3568693e-10 8.352833e-11 2.5913517e-10 ] [ 2.3612107e-10 4.0963874e-10 1.7241781e-10 ] [ 3.5519957e-10 2.1209662e-10 8.668259e-11 ] [ 3.6176257e-10 2.7530382e-10 3.2441155e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.3e-05 6.7e-06 -8.1e-06 ] [ 1.3e-06 9e-07 2.13e-05 ] [ -1.09e-05 3.2e-06 -1.1e-06 ] [ 2.02e-05 2.7e-06 -1.76e-05 ] [ 2.5e-06 -1.36e-05 5.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.08282960704e-14 1.073458335936e-14 -1.297763062848e-14 ] [ 2.08282960704e-15 1.44195895872e-15 3.412636202304e-14 ] [ -1.746372516672e-14 5.126965186560001e-15 -1.76239428288e-15 ] [ 3.236396774016e-14 4.32587687616e-15 -2.819830852608e-14 ] [ 4.005441552e-15 -2.178960204288e-14 8.972189076479999e-15 ] ] } "relaxed-potential-energy" { "source-value" -16.28693 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.609453847060615e-18 } }