{ "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" [ [ 0.9163946 0.5446671 1.49786 ] [ 0.0084298 2.294234 2.779305 ] [ 1.912564 0.4098673 0.1717336 ] [ 2.851379 0.2549877 2.412214 ] [ 1.718971 2.318251 1.204915 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 9.163945999999999e-11 5.446671e-11 1.49786e-10 ] [ 8.4298e-13 2.294234e-10 2.779305e-10 ] [ 1.912564e-10 4.098673e-11 1.717336e-11 ] [ 2.851379e-10 2.549877e-11 2.412214e-10 ] [ 1.718971e-10 2.318251e-10 1.204915e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -15.8696668 -12.9589874 2.0319973 ] [ -4.9984083 4.6580231 5.2227862 ] [ 6.2962161 -2.270242 -6.0425863 ] [ 8.1493999 -2.258069 2.2515487 ] [ 6.4224592 12.8292753 -3.463746 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.542600912684595e-08 -2.076258664152178e-08 3.255618567588724e-09 ] [ -8.008332919472674e-09 7.462975709966341e-09 8.367825945076873e-09 ] [ 1.008765023492455e-08 -3.637328655958234e-09 -9.681290499026374e-09 ] [ 1.305677799332986e-08 -3.617825359953235e-09 3.607378687732633e-09 ] [ 1.028991397828187e-08 2.055476494746691e-08 -5.549532861589517e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.84378684 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.351895547986711e-19 } "relaxed-configuration-positions" { "source-value" [ [ 0.6056426 0.0404532 1.6171163 ] [ 0.033736 2.2451138 2.6499582 ] [ 1.8791504 0.6411066 0.3186669 ] [ 3.0819078 -0.1835628 2.62491 ] [ 1.8073016 3.0788962 0.8553763 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 6.056426e-11 4.04532e-12 1.6171163e-10 ] [ 3.3736e-12 2.2451138e-10 2.6499582e-10 ] [ 1.8791504e-10 6.411066e-11 3.186669e-11 ] [ 3.0819078e-10 -1.835628e-11 2.62491e-10 ] [ 1.8073016e-10 3.0788962e-10 8.553763e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -2.76e-05 1.07e-05 -8.3e-06 ] [ 1.76e-05 -2.25e-05 -5.2e-06 ] [ 7e-06 1.1e-06 2.66e-05 ] [ 3.7e-06 9.9e-06 -6.1e-06 ] [ -8e-07 9e-07 -7e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -4.422007473408001e-14 1.714328984256e-14 -1.329806595264e-14 ] [ 2.819830852608e-14 -3.604897396800001e-14 -8.33131842816e-15 ] [ 1.12152363456e-14 1.76239428288e-15 4.261789811328e-14 ] [ 5.928053496960001e-15 1.586154854592e-14 -9.77327738688e-15 ] [ -1.28174129664e-15 1.44195895872e-15 -1.12152363456e-14 ] ] } "relaxed-potential-energy" { "source-value" -11.282995 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.80773508016033e-18 } }