{ "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" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.8884438 2.916456 2.400624 ] [ 2.811423 1.824332 1.936915 ] [ 1.907829 2.277214 4.357236 ] [ 1.702277 4.831739 3.243262 ] [ 3.61245 3.93555 1.732923 ] [ 3.530316 5.918227 2.544774 ] [ 3.982422 3.894872 3.827608 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 8.884438000000001e-11 2.916456e-10 2.400624e-10 ] [ 2.811423e-10 1.824332e-10 1.936915e-10 ] [ 1.907829e-10 2.277214e-10 4.357236e-10 ] [ 1.702277e-10 4.831739e-10 3.243262e-10 ] [ 3.61245e-10 3.93555e-10 1.732923e-10 ] [ 3.530316e-10 5.918227e-10 2.544774e-10 ] [ 3.982422e-10 3.894872e-10 3.827608e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.1747929 -0.8077779 -0.628659 ] [ 0.3108157 -1.3282039 -0.1980858 ] [ 0.6584439 -6e-06 0.3363985 ] [ -2.0863001 0.7998191 1.7030512 ] [ 1.2317961 -3.0458025 -6.9626266 ] [ 1.2583505 5.0806082 0.6254929 ] [ 0.8016868 -0.6986369 5.1244288 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.484402339461832e-09 -1.294202866178921e-09 -1.007222752255507e-09 ] [ 4.979816479175865e-10 -2.128017236235381e-09 -3.173684376724647e-10 ] [ 1.054943422688373e-09 -9.6130597248e-15 5.389698119721889e-10 ] [ -3.342621244192702e-09 1.281451462889297e-09 2.728588816665385e-09 ] [ 1.973554913012619e-09 -4.879913557074192e-09 -1.115535755788019e-08 ] [ 2.01609975187199e-09 8.140031677484771e-09 1.002150100856392e-09 ] [ 1.284443848163965e-09 -1.119339707608188e-09 8.210240018314198e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -17.673767 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.831649628886656e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.6345676 2.9652437 2.6112646 ] [ 2.6346661 1.9629392 1.7743266 ] [ 2.3847336 2.3874784 4.1318013 ] [ 1.0594507 5.1640659 3.2314341 ] [ 4.2393958 3.6564228 1.6280991 ] [ 3.2788938 5.5967349 2.6507967 ] [ 4.2034531 3.865505 4.0156196 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.345676e-11 2.9652437e-10 2.6112646e-10 ] [ 2.6346661e-10 1.9629392e-10 1.7743266e-10 ] [ 2.3847336e-10 2.3874784e-10 4.1318013e-10 ] [ 1.0594507e-10 5.1640659e-10 3.2314341e-10 ] [ 4.2393958e-10 3.6564228e-10 1.6280991e-10 ] [ 3.2788938e-10 5.5967349e-10 2.6507967e-10 ] [ 4.2034531e-10 3.865505e-10 4.0156196e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 0.0391335 -0.0822154 0.0719715 ] [ -0.0287084 0.0097412 -0.0037841 ] [ 0.0975929 -0.1088121 -0.0432347 ] [ -0.033898 0.1805975 -0.077844 ] [ -0.0139026 -0.0249902 -0.0046772 ] [ 0.011042 0.0586099 0.0074132 ] [ -0.0712594 -0.0329309 0.0501553 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 6.269877879007681e-11 -1.317235917497203e-10 1.153110546639072e-10 ] [ -4.599592730057472e-11 1.560712289853696e-11 -6.06279655076928e-12 ] [ 1.563610627360723e-10 -1.743362026801517e-10 -6.926962554730177e-11 ] [ -5.431058309187839e-11 2.89349092274928e-10 -1.247198368695552e-10 ] [ -2.227442068833408e-11 -4.003871418911616e-11 -7.493700490805762e-12 ] [ 1.76912342468736e-11 9.390341152742591e-11 1.187725572531456e-11 ] [ -1.141701446922355e-10 -5.276111808190272e-11 8.035764906921024e-11 ] ] } "relaxed-potential-energy" { "source-value" -21.903431 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.509316506350597e-18 } }