{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.5690072e-10 4.0821078e-10 2.8165238e-10 ] [ 3.985468700000001e-10 2.664435e-10 1.6612197e-10 ] [ 4.358252000000001e-10 4.9472653e-10 1.6328365e-10 ] ] "source-value" [ [ 2.5690072 4.0821078 2.8165238 ] [ 3.9854687 2.664435 1.6612197 ] [ 4.358252 4.9472653 1.6328365 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 8.526783975897601e-13 9.69316855584e-14 -5.96810791248e-13 ] [ -3.060157345728e-14 1.32628180669824e-12 1.594165737696e-13 ] [ -8.219166064704e-13 -1.42321349225664e-12 4.373942174784e-13 ] ] "source-value" [ [ 0.0005322 6.05e-05 -0.0003725 ] [ -1.91e-05 0.0008278 9.95e-05 ] [ -0.000513 -0.0008883 0.000273 ] ] } "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" -1.261083135704963e-18 "source-value" -7.8710619 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.404264228927114e-09 -1.082244672524467e-09 8.871473049743271e-10 ] [ 3.377194453275284e-10 3.074890801715215e-09 7.878415140992256e-11 ] [ 1.066544783599586e-09 -1.992646129190748e-09 -9.659314563842495e-10 ] ] "source-value" [ [ -0.8764728 -0.675484 0.5537138 ] [ 0.2107879 1.9191959 0.0491732 ] [ 0.6656849 -1.2437119 -0.602887 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -1.168654800127009e-18 "source-value" -7.2941696 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 2.672017e-10 4.0994e-10 2.745002e-10 ] [ 3.920865e-10 2.451348e-10 1.685084e-10 ] [ 4.319846e-10 5.14306e-10 1.680494e-10 ] ] "source-value" [ [ 2.672017 4.0994 2.745002 ] [ 3.920865 2.451348 1.685084 ] [ 4.319846 5.14306 1.680494 ] ] } "instance-id" 1 }