{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.9376879e-10 2.8705566e-10 2.5877092e-10 ] [ 4.0538539e-10 3.8232073e-10 4.100284000000001e-11 ] [ 3.5408052e-10 5.1968211e-10 2.2843136e-10 ] ] "source-value" [ [ 3.9376879 2.8705566 2.5877092 ] [ 4.0538539 3.8232073 0.4100284 ] [ 3.5408052 5.1968211 2.2843136 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.18977635860608e-12 -6.618751838186882e-12 4.1672613907008e-13 ] [ 1.1519649903552e-13 -5.8335250763328e-13 -3.957376253376001e-14 ] [ -1.3049728576416e-12 7.201944128158081e-12 -3.769921588742401e-13 ] ] "source-value" [ [ 0.0007426 -0.0041311 0.0002601 ] [ 7.19e-05 -0.0003641 -2.47e-05 ] [ -0.0008145 0.0044951 -0.0002353 ] ] } "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" -1.051419226927963e-18 "source-value" -6.5624427 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.644881876744448e-10 4.612253610368019e-09 -7.666240493276333e-10 ] [ -7.213276323396998e-10 1.924100847693709e-09 2.64509650903758e-09 ] [ 1.485815820014145e-09 -6.53635445806173e-09 -1.878472459709946e-09 ] ] "source-value" [ [ -0.477156 2.8787423 -0.4784891 ] [ -0.4502173 1.2009293 1.6509394 ] [ 0.9273733 -4.0796716 -1.1724503 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.573860731546567e-19 "source-value" -5.351383 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.985509e-10 2.643973e-10 2.549742e-10 ] [ 4.064558e-10 3.749686e-10 4.331692e-11 ] [ 3.48228e-10 5.496926e-10 2.29914e-10 ] ] "source-value" [ [ 3.985509 2.643973 2.549742 ] [ 4.064558 3.749686 0.4331692 ] [ 3.48228 5.496926 2.29914 ] ] } "instance-id" 1 }