{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 3.9446541e-10 2.8092006e-10 2.6215122e-10 ] [ 4.0627716e-10 3.8259424e-10 3.405277e-11 ] [ 3.5249213e-10 5.255441900000001e-10 2.3200114e-10 ] ] "source-value" [ [ 3.9446541 2.8092006 2.6215122 ] [ 4.0627716 3.8259424 0.3405277 ] [ 3.5249213 5.2554419 2.3200114 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ 1.345828361472e-14 -1.11879993430464e-12 1.45269354207936e-12 ] [ 2.074818723936e-13 2.6003326555584e-13 -1.8897673242336e-12 ] [ -2.211003736704e-13 8.587666687488e-13 4.3707378215424e-13 ] ] "source-value" [ [ 8.4e-06 -0.0006983 0.0009067 ] [ 0.0001295 0.0001623 -0.0011795 ] [ -0.000138 0.000536 0.0002728 ] ] } "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" -7.705318702581279e-19 "source-value" -4.8092817 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.223474939471366e-10 6.47301464840567e-10 3.34262108397504e-12 ] [ -2.891898359188204e-10 9.078043283639636e-10 8.711939517080352e-10 ] [ 4.115371696482951e-10 -1.555105793204531e-09 -8.745365727920102e-10 ] ] "source-value" [ [ -0.0763633 0.4040138 0.0020863 ] [ -0.1804981 0.5666069 0.5437565 ] [ 0.2568613 -0.9706207 -0.5458428 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -7.304234133207084e-19 "source-value" -4.5589444 } "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 }