{ "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" [ [ 1.947833 2.66109 2.800328 ] [ 2.760428 0.8143556 5.686562 ] [ 2.02068 0.2574425 3.346376 ] [ 3.738236 1.129785 1.86566 ] [ 4.311233 0.7772723 4.159405 ] [ 3.473629 2.806736 4.589232 ] [ 4.175068 3.516721 2.41803 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.947833e-10 2.66109e-10 2.800328e-10 ] [ 2.760428e-10 8.143556e-11 5.686562e-10 ] [ 2.02068e-10 2.574425e-11 3.346376e-10 ] [ 3.738236e-10 1.129785e-10 1.86566e-10 ] [ 4.311233e-10 7.772723e-11 4.159405e-10 ] [ 3.473629e-10 2.806736e-10 4.589232e-10 ] [ 4.175068e-10 3.516721e-10 2.41803e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -2.3520103 0.2041042 -0.1475771 ] [ -2.4372831 -1.188817 2.5280622 ] [ -2.1738792 -0.8113102 -0.1733733 ] [ 1.2609507 -0.1472624 -1.4197443 ] [ 4.4009299 -1.706989 -1.3058167 ] [ 0.2238278 3.3468604 1.4238914 ] [ 1.0774642 0.303414 -0.905442 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.768335914540794e-09 3.270109774470874e-10 -2.364445793854637e-10 ] [ -3.904958001090949e-09 -1.904694803809594e-09 4.050402152768214e-09 ] [ -3.482938430683407e-09 -1.299862234656572e-09 -2.777746479309447e-10 ] [ 2.020265731521394e-09 -2.359403744028979e-10 -2.274681124974061e-09 ] [ 7.051066995559682e-09 -2.734897867762772e-09 -2.092148987790208e-09 ] [ 3.586116682450982e-10 5.362261485961336e-09 2.281325511638181e-09 ] [ 1.726287950988975e-09 4.861228172234112e-10 -1.450678003890394e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.267511 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.965471931960683e-18 } "relaxed-configuration-positions" { "source-value" [ [ 1.6412793 2.8706822 3.170443 ] [ 2.6679694 0.7043367 5.1770777 ] [ 1.8581071 0.6015326 3.0451048 ] [ 3.9777914 0.8057741 2.1811098 ] [ 4.8714775 0.9166828 4.2789168 ] [ 3.5657037 2.9813921 4.7406835 ] [ 3.8447785 3.0830019 2.2722574 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 1.6412793e-10 2.8706822e-10 3.170443e-10 ] [ 2.6679694e-10 7.043367000000001e-11 5.177077700000001e-10 ] [ 1.8581071e-10 6.015326e-11 3.0451048e-10 ] [ 3.9777914e-10 8.057741000000001e-11 2.1811098e-10 ] [ 4.8714775e-10 9.166828000000001e-11 4.2789168e-10 ] [ 3.5657037e-10 2.9813921e-10 4.740683500000001e-10 ] [ 3.8447785e-10 3.0830019e-10 2.2722574e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 7.3e-06 -1.05e-05 3.8e-06 ] [ 3.2e-06 1.61e-05 1e-05 ] [ 6.4e-06 -5e-07 -2.9e-06 ] [ 1.7e-06 1.17e-05 -1.3e-06 ] [ -1.48e-05 -4.1e-06 -1.44e-05 ] [ -7.6e-06 -4.2e-06 -6.3e-06 ] [ 3.7e-06 -8.6e-06 1.1e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.169588933184e-14 -1.68228545184e-14 6.08827115904e-15 ] [ 5.126965186560001e-15 2.579504359488e-14 1.6021766208e-14 ] [ 1.025393037312e-14 -8.010883104e-16 -4.646312200320001e-15 ] [ 2.72370025536e-15 1.874546646336e-14 -2.08282960704e-15 ] [ -2.371221398784e-14 -6.568924145279999e-15 -2.307134333952e-14 ] [ -1.217654231808e-14 -6.72914180736e-15 -1.009371271104e-14 ] [ 5.928053496960001e-15 -1.377871893888e-14 1.76239428288e-14 ] ] } "relaxed-potential-energy" { "source-value" -14.445632 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.314445386308035e-18 } }