{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.913216e-11 6.380266999999999e-11 1.129266e-10 ] [ 2.7457181e-10 4.89759e-11 2.3880828e-10 ] [ 2.3282945e-10 2.4058433e-10 9.795252e-11 ] ] "source-value" [ [ 0.6913216 0.6380267 1.129266 ] [ 2.7457181 0.489759 2.3880828 ] [ 2.3282945 2.4058433 0.9795252 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -4.27204374170112e-12 -1.81478545838016e-12 -1.31987310021504e-12 ] [ 2.4665509077216e-12 -3.4623036775488e-13 1.614192945456e-12 ] [ 1.80549283397952e-12 2.16101582613504e-12 -2.9415962757888e-13 ] ] "source-value" [ [ -0.0026664 -0.0011327 -0.0008238 ] [ 0.0015395 -0.0002161 0.0010075 ] [ 0.0011269 0.0013488 -0.0001836 ] ] } "species" { "source-value" [ "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "relaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.850722679962805e-19 "source-value" -3.6517339 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.846552294893748e-09 5.668949493844224e-11 1.015351395341136e-09 ] [ -1.933816927375227e-09 1.678905980693746e-09 -2.12584804930848e-09 ] [ 8.726463248147904e-11 -1.735595475632189e-09 1.110496653967344e-09 ] ] "source-value" [ [ 1.1525273 0.0353828 0.6337325 ] [ -1.2069936 1.0478907 -1.32685 ] [ 0.0544663 -1.0832735 0.6931175 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.389517714634386e-19 "source-value" -3.3638724 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.176072000000001e-11 7.140121000000001e-11 1.097767e-10 ] [ 2.809034e-10 3.429818e-11 2.513803e-10 ] [ 2.238693e-10 2.476635e-10 8.853041000000001e-11 ] ] "source-value" [ [ 0.7176072 0.7140121 1.097767 ] [ 2.809034 0.3429818 2.513803 ] [ 2.238693 2.476635 0.8853041 ] ] } "instance-id" 1 }