{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.7315436 0.3767612 1.166558 ] [ 0.6069044 0.5624824 2.9402 ] [ 2.192795 0.1872249 0.2922769 ] [ 2.54678 0.883358 1.224646 ] [ 2.591807 0.3326772 2.854818 ] [ 2.523994 2.504234 0.7585561 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.315436e-11 3.767612e-11 1.166558e-10 ] [ 6.069044000000001e-11 5.624824e-11 2.9402e-10 ] [ 2.192795e-10 1.872249e-11 2.922769e-11 ] [ 2.54678e-10 8.83358e-11 1.224646e-10 ] [ 2.591807e-10 3.326772e-11 2.854818e-10 ] [ 2.523994e-10 2.504234e-10 7.585561e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -83.1980152 -9.1223618 -50.0971083 ] [ -16.5205973 7.5074643 71.2541121 ] [ -104.3643478 -310.9064477 -405.9118191 ] [ 190.4403027 271.2070257 347.7742358 ] [ 15.1565695 -26.697546 53.8586999 ] [ -1.513912 68.0118654 -16.8781204 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.33297914850403e-07 -1.461563480243901e-08 -8.026441568794563e-08 ] [ -2.64689147557116e-08 1.202828378295064e-08 1.141616725424824e-07 ] [ -1.672101180901999e-07 -4.98127041760918e-07 -6.503424266684189e-07 ] [ 3.051190006440151e-07 4.345215559732448e-07 5.571957499153463e-07 ] [ 2.428350130443035e-08 -4.277418403393256e-08 8.62911498064633e-08 ] [ -2.425554412348569e-09 1.089670206808765e-07 -2.704172990792755e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 208.15767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.335053523142015e-17 } "relaxed-configuration-positions" { "source-value" [ [ 0.3017442 0.9741318 0.7498088 ] [ 0.3856211 0.3459422 3.1508433 ] [ 2.0771682 -0.580036 -0.1201405 ] [ 3.5858648 0.943632 1.1938799 ] [ 2.8559127 0.3229825 3.4848598 ] [ 1.9875129 2.8400852 0.7778038 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.017442e-11 9.741318e-11 7.498088000000001e-11 ] [ 3.856211e-11 3.459422e-11 3.1508433e-10 ] [ 2.0771682e-10 -5.80036e-11 -1.201405e-11 ] [ 3.5858648e-10 9.436320000000001e-11 1.1938799e-10 ] [ 2.8559127e-10 3.229825e-11 3.4848598e-10 ] [ 1.9875129e-10 2.8400852e-10 7.778038e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.24e-05 3.4e-06 -1.1e-06 ] [ 9.3e-06 4e-06 -1.85e-05 ] [ -3.5e-06 1.3e-06 -4.9e-06 ] [ 1.72e-05 -2e-06 1.81e-05 ] [ 1.04e-05 7e-06 1.6e-06 ] [ -9e-07 -1.37e-05 4.7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.191052251392001e-14 5.44740051072e-15 -1.76239428288e-15 ] [ 1.490024257344e-14 6.4087064832e-15 -2.96402674848e-14 ] [ -5.6076181728e-15 2.08282960704e-15 -7.850665441919999e-15 ] [ 2.755743787776e-14 -3.2043532416e-15 2.899939683648e-14 ] [ 1.666263685632e-14 1.12152363456e-14 2.56348259328e-15 ] [ -1.44195895872e-15 -2.194981970496e-14 7.53023011776e-15 ] ] } "relaxed-potential-energy" { "source-value" -19.334204 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.097680963057785e-18 } }