{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.4314663 0.9036294 0.7794334 ] [ 1.004832 0.4139501 2.5602 ] [ 0.3021018 2.478458 1.913452 ] [ 2.709186 0.4632097 1.441964 ] [ 2.312911 2.26354 0.6044428 ] [ 2.800336 2.901369 2.552849 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 4.314663000000001e-11 9.036294e-11 7.794334000000001e-11 ] [ 1.004832e-10 4.139501e-11 2.5602e-10 ] [ 3.021018e-11 2.478458e-10 1.913452e-10 ] [ 2.709186e-10 4.632097e-11 1.441964e-10 ] [ 2.312911e-10 2.26354e-10 6.044428e-11 ] [ 2.800336e-10 2.901369e-10 2.552849e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -4.961451 -7.2700731 -18.2295335 ] [ -4.3819848 -9.1433421 19.2663934 ] [ -1.82326 12.1772203 7.0825426 ] [ 8.8972033 -7.0893243 0.1913544 ] [ 1.5134692 10.1327276 -12.761873 ] [ 0.7560232 1.1927915 4.4511161 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -7.949120797444782e-09 -1.164794115232698e-08 -2.920693238179039e-08 ] [ -7.020713599260964e-09 -1.464924894859638e-08 3.086816507261542e-08 ] [ -2.921184545639808e-09 1.951005767099116e-08 1.134748416954005e-08 ] [ 1.425489111776461e-08 -1.135834965072933e-08 3.065835459672115e-10 ] [ 2.42484496854088e-09 1.62344192656549e-08 -2.044677455821876e-08 ] [ 1.211282695822403e-09 1.911062654788963e-09 7.131474151886475e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -9.3598241 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.49960913478204e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5406129 0.6983305 0.4508591 ] [ 0.6227635 0.1859403 2.836617 ] [ 0.5316218 2.5592004 2.1739659 ] [ 2.7614332 0.5593509 1.6676746 ] [ 2.149072 2.5500558 0.2205692 ] [ 2.9553298 2.8712782 2.5026554 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.406129e-11 6.983305e-11 4.508591e-11 ] [ 6.227635e-11 1.859403e-11 2.836617e-10 ] [ 5.316218000000001e-11 2.5592004e-10 2.1739659e-10 ] [ 2.7614332e-10 5.593509e-11 1.6676746e-10 ] [ 2.149072e-10 2.5500558e-10 2.205692e-11 ] [ 2.9553298e-10 2.8712782e-10 2.5026554e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.52e-05 3.8e-05 -1.78e-05 ] [ -3.6e-06 -8.4e-06 5.27e-05 ] [ 2.47e-05 -2.69e-05 -2.4e-05 ] [ -1.37e-05 5.09e-05 -1.44e-05 ] [ -4.7e-06 -2.3e-05 -8e-07 ] [ -1.8e-05 -3.05e-05 4.3e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.435308463616e-14 6.08827115904e-14 -2.851874385024e-14 ] [ -5.76783583488e-15 -1.345828361472e-14 8.443470791616e-14 ] [ 3.957376253376001e-14 -4.309855109952001e-14 -3.84522388992e-14 ] [ -2.194981970496e-14 8.155078999872e-14 -2.307134333952e-14 ] [ -7.53023011776e-15 -3.68500622784e-14 -1.28174129664e-15 ] [ -2.88391791744e-14 -4.88663869344e-14 6.889359469440001e-15 ] ] } "relaxed-potential-energy" { "source-value" -18.293287 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.930907674898457e-18 } }