{ "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" [ [ 0.0909404 0.3504436 2.335509 ] [ 2.174921 0.6476227 0.0631824 ] [ 2.07151 0.3484765 2.894541 ] [ 2.345183 1.577217 1.820601 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.09404e-12 3.504436000000001e-11 2.335509e-10 ] [ 2.174921e-10 6.476227e-11 6.31824e-12 ] [ 2.07151e-10 3.484765e-11 2.894541e-10 ] [ 2.345183e-10 1.577217e-10 1.820601e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2995556 -0.8173815 -0.83846 ] [ -0.5294313 -2.5455745 -6.4924358 ] [ -1.962805 -26.0504223 25.2191235 ] [ 7.7917919 29.4133783 -17.8882277 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.490824082949716e-09 -1.309589529574435e-09 -1.343361009475968e-09 ] [ -8.482424511797511e-10 -4.078459950404649e-09 -1.040202885080495e-08 ] [ -3.144760282189344e-09 -4.173737757102696e-08 4.040549006876787e-08 ] [ 1.248382681631881e-08 4.712542705100605e-08 -2.866010020848696e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -0.63421006 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.016116530808165e-19 } "relaxed-configuration-positions" { "source-value" [ [ -0.2989608 -0.0232498 2.6978684 ] [ 2.2948901 0.8860375 -0.4305445 ] [ 1.8292919 0.4326525 3.237228 ] [ 2.8573332 1.6283196 1.6092815 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -2.989608000000001e-11 -2.32498e-12 2.6978684e-10 ] [ 2.2948901e-10 8.860375e-11 -4.305445e-11 ] [ 1.8292919e-10 4.326525e-11 3.237228e-10 ] [ 2.8573332e-10 1.6283196e-10 1.6092815e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.1e-06 1e-07 6e-07 ] [ 5e-07 7e-07 9e-07 ] [ -7e-07 6e-07 -1.1e-06 ] [ -9e-07 -1.4e-06 -4e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.76239428288e-15 1.6021766208e-16 9.6130597248e-16 ] [ 8.010883104e-16 1.12152363456e-15 1.44195895872e-15 ] [ -1.12152363456e-15 9.6130597248e-16 -1.76239428288e-15 ] [ -1.44195895872e-15 -2.24304726912e-15 -6.408706483200001e-16 ] ] } "relaxed-potential-energy" { "source-value" -9.6128621 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.540150291559439e-18 } }