{ "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" [ [ 2.905521 1.741541 1.432593 ] [ 2.475113 5.398899 1.710867 ] [ 1.47054 3.340259 2.516001 ] [ 3.027539 3.458512 0.3041981 ] [ 3.800453 3.660633 2.737021 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.905521e-10 1.741541e-10 1.432593e-10 ] [ 2.475113e-10 5.398899000000001e-10 1.710867e-10 ] [ 1.47054e-10 3.340259e-10 2.516001e-10 ] [ 3.027539e-10 3.458512e-10 3.041981e-11 ] [ 3.800453e-10 3.660633e-10 2.737021e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.1171701 -4.6181117 0.7829234 ] [ -0.3584623 1.8071615 -0.486711 ] [ -4.2644624 -0.4195643 2.470207 ] [ 1.0588335 2.5376343 -6.0785902 ] [ 3.6812613 0.6928802 3.3121708 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.877271948767981e-10 -7.399030597982944e-09 1.254381567357247e-09 ] [ -5.743199164981958e-10 2.895391905309859e-09 -7.797969852861888e-10 ] [ -6.832421957560658e-09 -6.722161123823175e-10 3.957707903936506e-09 ] [ 1.696438279019837e-09 4.065738347600174e-09 -9.738975105863997e-09 ] [ 5.898030789915815e-09 1.110116457455228e-09 5.306682619856432e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8614243 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.099321359884901e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9231674 1.9739467 1.6869878 ] [ 2.5484868 5.0659902 1.7932901 ] [ 1.1203137 3.301166 2.4103336 ] [ 2.9612795 3.6073137 -0.0058526 ] [ 4.1259187 3.6514274 2.8159212 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9231674e-10 1.9739467e-10 1.6869878e-10 ] [ 2.5484868e-10 5.0659902e-10 1.7932901e-10 ] [ 1.1203137e-10 3.301166e-10 2.4103336e-10 ] [ 2.9612795e-10 3.6073137e-10 -5.852600000000001e-13 ] [ 4.1259187e-10 3.6514274e-10 2.8159212e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 8.3e-06 1.04e-05 -8.2e-06 ] [ 1.64e-05 -1.81e-05 -2.4e-06 ] [ 1.05e-05 4.1e-06 -3.1e-06 ] [ -1.38e-05 -2e-06 1.23e-05 ] [ -2.14e-05 5.7e-06 1.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.329806595264e-14 1.666263685632e-14 -1.313784829056e-14 ] [ 2.627569658112e-14 -2.899939683648e-14 -3.84522388992e-15 ] [ 1.68228545184e-14 6.568924145279999e-15 -4.96674752448e-15 ] [ -2.211003736704e-14 -3.2043532416e-15 1.970677243584e-14 ] [ -3.428657968511999e-14 9.13240673856e-15 2.08282960704e-15 ] ] } "relaxed-potential-energy" { "source-value" -8.7233245 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.397630656955185e-18 } }