{ "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" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.7912618 -7.1260818 -1.8404025 ] [ 2.3049768 11.6811334 -5.3318343 ] [ 20.5678261 6.4922694 -1.8787424 ] [ 4.6326791 22.3598709 -20.8198566 ] [ 7.808076 -28.4069246 18.1936726 ] [ -17.8058415 -22.4560227 15.6721043 ] [ -11.7164547 17.4557555 -3.9949411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.27862433733678e-09 -1.141724175193266e-08 -2.948649882655184e-09 ] [ 3.692979970872091e-09 1.871523899211697e-08 -8.542540331819744e-09 ] [ 3.295329038959534e-08 1.04017623343132e-08 -3.010077174585081e-09 ] [ 7.422370206840149e-09 3.582446269523654e-08 -3.335708776775068e-08 ] [ 1.250991692369618e-08 -4.551291083791979e-08 2.914947712636602e-08 ] [ -2.852810320000751e-08 -3.597851486251359e-08 2.510947931507093e-08 ] [ -1.877182995365948e-08 2.796720359091698e-08 -6.400601284626257e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -4.592358276367165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.357769125351985e-19 } "relaxed-configuration-positions" { "source-value" [ [ 1.43906 1.00085 1.609326 ] [ 1.205531 2.018769 3.811036 ] [ 1.566383 3.683465 1.956037 ] [ 3.913976 1.646449 1.998722 ] [ 3.334697 0.9502568 4.182978 ] [ 3.589337 3.768444 1.401362 ] [ 3.236168 3.404887 3.941176 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.43906e-10 1.00085e-10 1.609326e-10 ] [ 1.205531e-10 2.018769e-10 3.811036e-10 ] [ 1.566383e-10 3.683465e-10 1.956037e-10 ] [ 3.913976e-10 1.646449e-10 1.998722e-10 ] [ 3.334697e-10 9.502568000000001e-11 4.182978000000001e-10 ] [ 3.589337e-10 3.768444e-10 1.401362e-10 ] [ 3.236168e-10 3.404887e-10 3.941176e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -5.7912618 -7.1260818 -1.8404025 ] [ 2.3049768 11.6811334 -5.3318343 ] [ 20.5678261 6.4922694 -1.8787424 ] [ 4.6326791 22.3598709 -20.8198566 ] [ 7.808076 -28.4069246 18.1936726 ] [ -17.8058415 -22.4560227 15.6721043 ] [ -11.7164547 17.4557555 -3.9949411 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.27862433733678e-09 -1.141724175193266e-08 -2.948649882655184e-09 ] [ 3.692979970872091e-09 1.871523899211697e-08 -8.542540331819744e-09 ] [ 3.295329038959534e-08 1.04017623343132e-08 -3.010077174585081e-09 ] [ 7.422370206840149e-09 3.582446269523654e-08 -3.335708776775068e-08 ] [ 1.250991692369618e-08 -4.551291083791979e-08 2.914947712636602e-08 ] [ -2.852810320000751e-08 -3.597851486251359e-08 2.510947931507093e-08 ] [ -1.877182995365948e-08 2.796720359091698e-08 -6.400601284626257e-09 ] ] } "relaxed-potential-energy" { "source-value" -4.592358276367165 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -7.357769125351985e-19 } }