{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.683716 2.607351 2.520111 ] [ 4.637842 1.301932 1.847927 ] [ 5.191502 3.374533 2.444496 ] [ 3.483741 4.863871 2.209214 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.683716e-10 2.607351e-10 2.520111e-10 ] [ 4.637842e-10 1.301932e-10 1.847927e-10 ] [ 5.191502e-10 3.374533e-10 2.444496e-10 ] [ 3.483741e-10 4.863871e-10 2.209214e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.2561057 0.0164161 -0.1137627 ] [ -0.6990949 -0.7561169 -0.2415988 ] [ 1.0066723 0.7604806 0.4431912 ] [ -0.5636832 -0.0207798 -0.0878298 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.103265649936186e-10 2.630149162471488e-11 -1.822679382590842e-10 ] [ -1.120073504500514e-09 -1.211432819771772e-09 -3.870839489733351e-10 ] [ 1.612866823866964e-09 1.218424237891957e-09 7.10070579184297e-10 ] [ -9.031200445777306e-10 -3.329290974489984e-11 -1.407188521695399e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -3.53655962032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.666193141753436e-19 } "relaxed-configuration-positions" { "source-value" [ [ 2.413249 2.5316018 2.2656914 ] [ 4.5012316 1.4580328 2.095085 ] [ 5.5851506 3.5422457 2.245116 ] [ 3.4971698 4.6158067 2.4158556 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.413249e-10 2.5316018e-10 2.2656914e-10 ] [ 4.5012316e-10 1.4580328e-10 2.095085e-10 ] [ 5.585150600000001e-10 3.5422457e-10 2.245116e-10 ] [ 3.4971698e-10 4.615806700000001e-10 2.4158556e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -3.2e-06 1.87e-05 1.03e-05 ] [ 1.76e-05 -3.35e-05 -1.21e-05 ] [ -2.13e-05 1.32e-05 1.04e-05 ] [ 6.8e-06 1.6e-06 -8.6e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -5.126965186560001e-15 2.996070280896e-14 1.650241919424e-14 ] [ 2.819830852608e-14 -5.36729167968e-14 -1.938633711168e-14 ] [ -3.412636202304e-14 2.114873139456e-14 1.666263685632e-14 ] [ 1.089480102144e-14 2.56348259328e-15 -1.377871893888e-14 ] ] } "relaxed-potential-energy" { "source-value" -3.86421462032712 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.19115432244166e-19 } }