{ "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" [ [ 0.5353879 0.9970923 2.660459 ] [ 0.8434423 2.30713 1.528251 ] [ 1.912844 1.041012 0.0827139 ] [ 2.263312 0.2132627 1.656325 ] [ 2.91731 1.870919 1.650254 ] [ 2.184429 2.813613 2.907386 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.353879e-11 9.970923e-11 2.660459e-10 ] [ 8.434423e-11 2.30713e-10 1.528251e-10 ] [ 1.912844e-10 1.041012e-10 8.27139e-12 ] [ 2.263312e-10 2.132627e-11 1.656325e-10 ] [ 2.91731e-10 1.870919e-10 1.650254e-10 ] [ 2.184429e-10 2.813613e-10 2.907386e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -22.9866256 -66.0376018 55.7297374 ] [ -34.0004492 80.2070942 -48.0205382 ] [ -39.1278809 -14.8625848 -86.1301063 ] [ -1.765348 -50.1796055 29.2018543 ] [ 132.1620356 9.4372845 1.3162353 ] [ -34.2817319 41.4354135 47.9028174 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.682863443082622e-08 -1.058039025693563e-07 8.92888830812359e-08 ] [ -5.447472525374399e-08 1.285059322082769e-07 -7.69373842561444e-08 ] [ -6.268977651591489e-08 -2.381248608740356e-08 -1.379956437977962e-07 ] [ -2.828399316478631e-09 -8.039659143543788e-08 4.678652862893242e-08 ] [ 2.117469253401961e-07 1.512019671431037e-08 2.10884144250598e-09 ] [ -5.492538982323242e-08 6.638685132982816e-08 7.674877474104862e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 62.101631 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 9.949778212149005e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.5210186 0.8784467 3.1229826 ] [ 0.2128083 2.5934002 1.1535295 ] [ 1.9311037 1.3343101 -0.2117231 ] [ 2.239356 -0.3806114 1.7577562 ] [ 3.7353755 1.7792171 1.6487847 ] [ 2.0170631 3.0382663 3.0140591 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.210186e-11 8.784467000000001e-11 3.1229826e-10 ] [ 2.128083e-11 2.5934002e-10 1.1535295e-10 ] [ 1.9311037e-10 1.3343101e-10 -2.117231e-11 ] [ 2.239356e-10 -3.806114e-11 1.7577562e-10 ] [ 3.7353755e-10 1.7792171e-10 1.6487847e-10 ] [ 2.0170631e-10 3.0382663e-10 3.0140591e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.44e-05 1.68e-05 1.45e-05 ] [ 1.76e-05 -1.89e-05 -9.2e-06 ] [ 1.34e-05 5.5e-06 2.1e-05 ] [ -1.24e-05 1.02e-05 -2.25e-05 ] [ -5.72e-05 1.19e-05 1.89e-05 ] [ 1.43e-05 -2.56e-05 -2.27e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 3.909310986959999e-14 2.691656745119999e-14 2.3231561193e-14 ] [ 2.81983087584e-14 -3.02811383826e-14 -1.47400250328e-14 ] [ 2.14691668956e-14 8.811971486999999e-15 3.364570931399999e-14 ] [ -1.98669902616e-14 1.63422016668e-14 -3.6048974265e-14 ] [ -9.164450346479999e-14 1.90659019446e-14 3.02811383826e-14 ] [ 2.29111258662e-14 -4.10157218304e-14 -3.636940959179999e-14 ] ] } "relaxed-potential-energy" { "source-value" -19.960428 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.198013134623935e-18 } }