{ "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" [ [ 1.919195 1.598632 0.607522 ] [ 2.894266 0.8592219 2.792014 ] [ 2.250891 3.034774 3.11288 ] [ 5.028948 2.389792 2.243338 ] [ 4.250492 2.740815 4.381763 ] [ 4.34969 4.079675 2.747402 ] [ 3.264148 3.629997 0.8600408 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.919195e-10 1.598632e-10 6.07522e-11 ] [ 2.894266e-10 8.592219e-11 2.792014e-10 ] [ 2.250891e-10 3.034774e-10 3.11288e-10 ] [ 5.028948e-10 2.389792e-10 2.243338e-10 ] [ 4.250492000000001e-10 2.740815e-10 4.381763e-10 ] [ 4.34969e-10 4.079675e-10 2.747402e-10 ] [ 3.264148e-10 3.629997e-10 8.600408e-11 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.3624953 0.5709347 1.3326791 ] [ 0.2658016 -0.0375192 -1.4237298 ] [ -3.7441329 0.5248666 0.8376769 ] [ 7.2217619 -14.0760937 -5.8216963 ] [ -0.6103838 -3.2393292 6.699078 ] [ -1.97865 17.2663283 1.4936733 ] [ -2.5168921 -1.0091876 -3.1176812 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 2.182958115609882e-09 9.147382283434618e-10 2.135187297048785e-09 ] [ 4.258611092912333e-10 -6.011238507111936e-11 -2.28106659989626e-09 ] [ -5.998762197548104e-09 8.409289955587852e-10 1.342106344964219e-09 ] [ 1.157053807716419e-08 -2.255238823833017e-08 -9.327385705257863e-09 ] [ -9.779426540750632e-10 -5.189977511314767e-09 1.073310615251562e-08 ] [ -3.17014677074592e-09 2.766370752931741e-08 2.393128440373184e-09 ] [ -4.032505679696216e-09 -1.616896778721262e-09 -4.995075929747689e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -15.914433 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.549773248588801e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.9135405 2.3786279 1.1865725 ] [ 2.9515732 0.4713049 2.3220731 ] [ 1.960958 2.2883874 3.6342149 ] [ 4.885352 1.7368726 2.3312718 ] [ 4.048649 3.2127525 4.0069152 ] [ 4.2109849 4.914061 2.4614772 ] [ 3.9865724 3.3309006 0.802435 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.9135405e-10 2.3786279e-10 1.1865725e-10 ] [ 2.9515732e-10 4.713049e-11 2.3220731e-10 ] [ 1.960958e-10 2.2883874e-10 3.6342149e-10 ] [ 4.885352000000001e-10 1.7368726e-10 2.3312718e-10 ] [ 4.048649e-10 3.2127525e-10 4.0069152e-10 ] [ 4.2109849e-10 4.914061000000001e-10 2.4614772e-10 ] [ 3.9865724e-10 3.3309006e-10 8.02435e-11 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 2.64e-05 6.56e-05 -2.26e-05 ] [ 1.28e-05 1.73e-05 2.04e-05 ] [ -8e-06 6.6e-06 -2.46e-05 ] [ 3.18e-05 -1.05e-05 6.6e-06 ] [ 3.65e-05 1.87e-05 1.83e-05 ] [ -5.39e-05 -8.12e-05 2e-06 ] [ -4.55e-05 -1.65e-05 -1e-07 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.229746278912e-14 1.0510278632448e-13 -3.620919163008e-14 ] [ 2.050786074624e-14 2.771765553984e-14 3.268440306432e-14 ] [ -1.28174129664e-14 1.057436569728e-14 -3.941354487168e-14 ] [ 5.094921654144e-14 -1.68228545184e-14 1.057436569728e-14 ] [ 5.84794466592e-14 2.996070280896e-14 2.931983216064e-14 ] [ -8.635731986112e-14 -1.3009674160896e-13 3.2043532416e-15 ] [ -7.28990362464e-14 -2.64359142432e-14 -1.6021766208e-16 ] ] } "relaxed-potential-energy" { "source-value" -22.541842 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -3.611601224216751e-18 } }