{ "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" [ [ 2.302316 2.639916 2.839286 ] [ 2.238062 3.048613 5.055223 ] [ 2.960065 4.797857 2.877262 ] [ 0.8426098 4.264099 3.709155 ] [ 4.78415 2.692863 2.00084 ] [ 4.277135 2.539995 4.347514 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.302316e-10 2.639916e-10 2.839286e-10 ] [ 2.238062e-10 3.048613e-10 5.055223e-10 ] [ 2.960065e-10 4.797856999999999e-10 2.877262e-10 ] [ 8.426098e-11 4.264099e-10 3.709155e-10 ] [ 4.78415e-10 2.692863e-10 2.00084e-10 ] [ 4.277135e-10 2.539995e-10 4.347514000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.7126889 -1.2630987 -1.1812869 ] [ -0.855922 -0.0342312 1.7458908 ] [ 0.8900387 0.3450902 -0.503412 ] [ -0.4288937 0.5104624 -0.1741132 ] [ -1.3651887 0.6722116 0.8961566 ] [ 1.0472769 -0.2304342 -0.7832354 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.141853493483669e-09 -2.023707206902873e-09 -1.892630253637308e-09 ] [ -1.371338217628378e-09 -5.484442834192897e-11 2.797225422229809e-09 ] [ 1.425999196747225e-09 5.528954505071962e-10 -8.065549370301697e-10 ] [ -6.871634589484089e-10 8.178509230774579e-10 -2.789600984126745e-10 ] [ -2.187273418120345e-09 1.077001709750561e-09 1.435801153095617e-09 ] [ 1.677922564683899e-09 -3.691962878727513e-10 -1.254881446462936e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.782795 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.528682515987914e-18 } "relaxed-configuration-positions" { "source-value" [ [ 2.3861649 2.5421573 2.8844527 ] [ 2.1293236 2.81013 5.265848 ] [ 2.7996683 4.7658643 2.0520031 ] [ 1.2589729 4.4583191 3.8153918 ] [ 4.622248 3.3077825 2.4126556 ] [ 4.2079601 2.0990897 4.3989287 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.3861649e-10 2.5421573e-10 2.8844527e-10 ] [ 2.1293236e-10 2.81013e-10 5.265848e-10 ] [ 2.7996683e-10 4.7658643e-10 2.0520031e-10 ] [ 1.2589729e-10 4.4583191e-10 3.8153918e-10 ] [ 4.622248e-10 3.3077825e-10 2.4126556e-10 ] [ 4.2079601e-10 2.0990897e-10 4.3989287e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7e-07 1e-07 8.4e-06 ] [ -1.8e-06 9e-06 1.28e-05 ] [ 4.2e-06 2.8e-06 6.8e-06 ] [ -2e-06 -8.8e-06 -1.39e-05 ] [ 1.8e-06 1.06e-05 -1.07e-05 ] [ -3e-06 -1.36e-05 -3.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.12152363456e-15 1.6021766208e-16 1.345828361472e-14 ] [ -2.88391791744e-15 1.44195895872e-14 2.050786074624e-14 ] [ 6.72914180736e-15 4.48609453824e-15 1.089480102144e-14 ] [ -3.2043532416e-15 -1.409915426304e-14 -2.227025502912e-14 ] [ 2.88391791744e-15 1.698307218048e-14 -1.714328984256e-14 ] [ -4.8065298624e-15 -2.178960204288e-14 -5.44740051072e-15 ] ] } "relaxed-potential-energy" { "source-value" -17.07948 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.736434355142119e-18 } }