{ "relaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 7.760292e-11 1.2438246e-10 2.5675411e-10 ] [ 1.6882704e-10 2.3060157e-10 5.767983e-11 ] [ 2.7254163e-10 2.6890507e-10 2.744962e-10 ] ] "source-value" [ [ 0.7760292 1.2438246 2.5675411 ] [ 1.6882704 2.3060157 0.5767983 ] [ 2.7254163 2.6890507 2.744962 ] ] } "relaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -7.674426013632e-12 -5.921965225800961e-12 5.4970679859648e-13 ] [ -2.4176845207872e-13 3.4719167372736e-13 -2.85171416736192e-12 ] [ 7.91619446571072e-12 5.57461333441152e-12 2.30200736876544e-12 ] ] "source-value" [ [ -0.00479 -0.0036962 0.0003431 ] [ -0.0001509 0.0002167 -0.0017799 ] [ 0.0049409 0.0034794 0.0014368 ] ] } "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" -1.20729784223998e-18 "source-value" -7.5353605 } "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -1.579731408083889e-09 -1.376135775301701e-09 9.577251077325121e-10 ] [ -4.067896159073067e-09 -1.08869519581747e-09 -1.072696869453432e-08 ] [ 5.647627567156956e-09 2.464831131336833e-09 9.769243586801812e-09 ] ] "source-value" [ [ -0.9859908 -0.8589164 0.597765 ] [ -2.5389811 -0.6795101 -6.6952473 ] [ 3.5249719 1.5384266 6.0974823 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -8.0902770438318e-19 "source-value" -5.0495538 } "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 6.858379e-11 1.161887e-10 2.640332e-10 ] [ 1.905052e-10 2.413634e-10 8.818854e-11 ] [ 2.598826e-10 2.66337e-10 2.367084e-10 ] ] "source-value" [ [ 0.6858379 1.161887 2.640332 ] [ 1.905052 2.413634 0.8818854 ] [ 2.598826 2.66337 2.367084 ] ] } "instance-id" 1 }