{ "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" [ [ 3.044824 1.955008 1.363184 ] [ 4.804837 1.704442 0.3842414 ] [ 5.395877 3.200403 2.033527 ] [ 3.92549 3.943599 0.3069547 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.044824e-10 1.955008e-10 1.363184e-10 ] [ 4.804837e-10 1.704442e-10 3.842414e-11 ] [ 5.395877e-10 3.200403e-10 2.033527e-10 ] [ 3.92549e-10 3.943599e-10 3.069547e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -7.7560142 -4.1997324 3.9249237 ] [ 5.6950527 -9.594281 -5.102316 ] [ 5.2417864 2.3897715 6.2851471 ] [ -3.1808249 11.404242 -5.1077548 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.242650462183282e-08 -6.728713064896274e-09 6.288420990563833e-09 ] [ 9.124480290163915e-09 -1.537173271158565e-08 -8.174811407133773e-09 ] [ 8.398267621307396e-09 3.828836026354147e-09 1.006991574190892e-08 ] [ -5.096243289638498e-09 1.827160991034543e-08 -8.18352532533898e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -6.8772189 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.101851933770389e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.9701981 2.0647579 1.6393932 ] [ 5.020727 1.6236533 0.1029155 ] [ 5.269811 3.1408404 2.1995935 ] [ 3.9102919 3.9742004 0.1460049 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.9701981e-10 2.0647579e-10 1.6393932e-10 ] [ 5.020727e-10 1.6236533e-10 1.029155e-11 ] [ 5.269811e-10 3.1408404e-10 2.1995935e-10 ] [ 3.9102919e-10 3.9742004e-10 1.460049e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 9.1e-06 -2.79e-05 1.58e-05 ] [ -1.77e-05 -1.33e-05 -1.57e-05 ] [ -1.83e-05 2.06e-05 6.7e-06 ] [ 2.69e-05 2.06e-05 -6.8e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.457980724928e-14 -4.470072772032e-14 2.531439060864e-14 ] [ -2.835852618816e-14 -2.130894905664e-14 -2.515417294656e-14 ] [ -2.931983216064e-14 3.300483838848e-14 1.073458335936e-14 ] [ 4.309855109952001e-14 3.300483838848e-14 -1.089480102144e-14 ] ] } "relaxed-potential-energy" { "source-value" -10.803692 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.730942274072399e-18 } }