{ "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" [ [ 0.421878 2.270641 0.131256 ] [ 0.1151872 2.83342 1.501847 ] [ 1.874433 0.2983712 0.2433776 ] [ 2.499725 0.6406393 2.506935 ] [ 1.789352 2.803582 2.39627 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.21878e-11 2.270641e-10 1.31256e-11 ] [ 1.151872e-11 2.83342e-10 1.501847e-10 ] [ 1.874433e-10 2.983712e-11 2.433776e-11 ] [ 2.499725e-10 6.406393e-11 2.506935e-10 ] [ 1.789352e-10 2.803582e-10 2.39627e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 7.6324184 -16.6060502 -35.0270469 ] [ -12.9046109 14.2468246 29.7252988 ] [ 0.9663895 3.895217 9.8655605 ] [ -4.5420454 5.2962026 -10.2783054 ] [ 8.8478483 -6.832194 5.7144929 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.222848232064374e-08 -2.660582539427116e-08 -5.611951563884512e-08 ] [ -2.067546588450085e-08 2.282592929475831e-08 4.76251787836543e-08 ] [ 1.548326663486602e-09 6.240825610342714e-09 1.580637038418796e-08 ] [ -7.277158950492185e-09 8.485451984740173e-09 -1.646766061332239e-08 ] [ 1.417581569064503e-08 -1.094638149557004e-08 9.155626924107593e-09 ] ] } "unrelaxed-potential-energy" { "source-value" 2.3698322 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 3.79688974605903e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.2888999 1.8397886 -0.2010126 ] [ 0.2014478 3.2591059 1.4907118 ] [ 1.8290685 0.323089 0.2589279 ] [ 2.6935238 0.8050415 2.2349037 ] [ 1.6876351 2.6196284 2.9961548 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.888999e-11 1.8397886e-10 -2.010126e-11 ] [ 2.014478e-11 3.2591059e-10 1.4907118e-10 ] [ 1.8290685e-10 3.23089e-11 2.589279e-11 ] [ 2.6935238e-10 8.050415e-11 2.2349037e-10 ] [ 1.6876351e-10 2.6196284e-10 2.9961548e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -1.66e-05 -4.26e-05 -1.74e-05 ] [ 4.64e-05 3.51e-05 9.8e-06 ] [ -1.77e-05 -4.5e-06 -2.82e-05 ] [ 3.66e-05 9.8e-06 -2e-06 ] [ -4.88e-05 2.3e-06 3.78e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.659613190528e-14 -6.825272404608e-14 -2.787787320192e-14 ] [ 7.434099520512001e-14 5.623639939008e-14 1.570133088384e-14 ] [ -2.835852618816e-14 -7.2097947936e-15 -4.518138070656001e-14 ] [ 5.863966432128e-14 1.570133088384e-14 -3.2043532416e-15 ] [ -7.818621909504e-14 3.68500622784e-15 6.056227626623999e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.370748 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.821794660660836e-18 } }