{ "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" [ [ 2.990348 2.100415 1.411886 ] [ 2.946969 3.752547 2.888488 ] [ 5.496135 2.06422 2.457996 ] [ 4.937229 4.674633 2.559339 ] [ 4.468449 3.37128 4.359326 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.990348e-10 2.100415e-10 1.411886e-10 ] [ 2.946969e-10 3.752547e-10 2.888488e-10 ] [ 5.496135e-10 2.06422e-10 2.457996e-10 ] [ 4.937229e-10 4.674633e-10 2.559339e-10 ] [ 4.468449e-10 3.37128e-10 4.359326000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.1105755 -4.6771663 -2.9826717 ] [ -5.4941661 0.810179 -1.1552293 ] [ -2.1332077 1.3743894 -0.0199413 ] [ 5.4040425 4.3840587 -0.9871296 ] [ 3.3339067 -1.8914608 5.1449719 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.779338116392867e-09 -7.493646559192233e-09 -4.778766904633057e-09 ] [ -8.802624548734906e-09 1.298049863157486e-09 -1.850881391372176e-09 ] [ -3.417775532408881e-09 2.20201458269728e-09 -3.194948491158419e-11 ] [ 8.658230622642944e-09 7.024036411224415e-09 -1.581555979849766e-09 ] [ 5.341507414676047e-09 -3.030454297886947e-09 8.243153760766584e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -11.718498 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.877510368117573e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.0006045 1.7930435 1.336782 ] [ 2.9587133 3.7022116 2.7606313 ] [ 5.0837443 2.3314685 2.3588616 ] [ 5.1800718 4.7845115 2.6581943 ] [ 4.615996 3.3518598 4.5625659 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.0006045e-10 1.7930435e-10 1.336782e-10 ] [ 2.9587133e-10 3.7022116e-10 2.7606313e-10 ] [ 5.083744300000001e-10 2.3314685e-10 2.3588616e-10 ] [ 5.1800718e-10 4.7845115e-10 2.6581943e-10 ] [ 4.615996e-10 3.3518598e-10 4.5625659e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -4.7e-06 3.5e-06 0.0 ] [ 1.2e-06 -5.3e-06 -2.6e-06 ] [ 4e-06 -2.1e-06 8e-07 ] [ -0.0 2.8e-06 -6e-07 ] [ -5e-07 1e-06 2.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.530230179799999e-15 5.607618218999999e-15 0.0 ] [ 1.9226119608e-15 -8.4915361602e-15 -4.165659248399999e-15 ] [ 6.408706535999999e-15 -3.364570931399999e-15 1.2817413072e-15 ] [ 0.0 4.486094575199999e-15 -9.613059803999998e-16 ] [ -8.010883169999999e-16 1.602176634e-15 3.685006258199999e-15 ] ] } "relaxed-potential-energy" { "source-value" -14.106836 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.260164301887002e-18 } }