{ "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" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 1.558502 1.467528 2.474942 ] [ 1.379624 2.873279 4.407553 ] [ 1.24144 3.597751 1.918679 ] [ 3.591005 1.301821 3.64335 ] [ 3.465479 3.687448 2.931727 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.558502e-10 1.467528e-10 2.474942e-10 ] [ 1.379624e-10 2.873279e-10 4.407553e-10 ] [ 1.24144e-10 3.597751e-10 1.918679e-10 ] [ 3.591005e-10 1.301821e-10 3.64335e-10 ] [ 3.465479e-10 3.687448e-10 2.931727e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -0.606647 -2.387708 -0.4004125 ] [ -0.1744871 0.299733 0.9610677 ] [ -0.0401045 1.4634895 -0.6921736 ] [ 0.332412 0.2079973 -0.0125566 ] [ 0.4888267 0.4164882 0.144075 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.719556404784576e-10 -3.825529934897126e-09 -6.4153154617608e-10 ] [ -2.795591522511917e-10 4.802252050822464e-10 1.539800199946028e-09 ] [ -6.42544922888736e-11 2.344768661686281e-09 -1.108984359454971e-09 ] [ 5.325827348733696e-10 3.332484112495238e-10 -2.011789095673728e-11 ] [ 7.831867103628154e-10 6.672876568790745e-10 2.3083359664176e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -9.8723664 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.581727463805146e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.3427197 1.1776152 2.4324125 ] [ 1.5111277 2.8763323 4.3939397 ] [ 1.345548 3.5960818 1.9007175 ] [ 3.5169156 1.4296692 3.5904369 ] [ 3.519739 3.8481285 3.0587444 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.3427197e-10 1.1776152e-10 2.4324125e-10 ] [ 1.5111277e-10 2.8763323e-10 4.3939397e-10 ] [ 1.345548e-10 3.5960818e-10 1.9007175e-10 ] [ 3.5169156e-10 1.4296692e-10 3.5904369e-10 ] [ 3.519739e-10 3.8481285e-10 3.0587444e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 1.4e-06 -1.03e-05 -1.92e-05 ] [ -1.63e-05 1.54e-05 4.88e-05 ] [ -7.4e-06 8e-07 -2.19e-05 ] [ 1e-05 -1.92e-05 -2.7e-06 ] [ 1.22e-05 1.33e-05 -5e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.24304726912e-15 -1.650241919424e-14 -3.076179111936e-14 ] [ -2.611547891904e-14 2.467351996032e-14 7.818621909504e-14 ] [ -1.185610699392e-14 1.28174129664e-15 -3.508766799552e-14 ] [ 1.6021766208e-14 -3.076179111936e-14 -4.32587687616e-15 ] [ 1.954655477376e-14 2.130894905664e-14 -8.010883104e-15 ] ] } "relaxed-potential-energy" { "source-value" -10.344766 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.657414223284673e-18 } }