{ "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" [ [ 0.7955699 1.924478 0.0578634 ] [ 0.2789322 2.342777 2.34838 ] [ 2.533834 0.6960937 0.5593318 ] [ 1.694509 0.4311754 2.932881 ] [ 2.816233 2.726519 1.407602 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.955699e-11 1.924478e-10 5.786340000000001e-12 ] [ 2.789322e-11 2.342777e-10 2.34838e-10 ] [ 2.533834e-10 6.960937e-11 5.593318000000001e-11 ] [ 1.694509e-10 4.311754e-11 2.932881e-10 ] [ 2.816233e-10 2.726519e-10 1.407602e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -6.0713912 0.6163039 -4.4173519 ] [ 1.2606376 0.0708231 0.8591651 ] [ 2.3325043 -5.4217063 0.0699422 ] [ 0.9626259 2.3765474 -1.9115057 ] [ 1.5156233 2.3580319 5.3997503 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -9.727441036370857e-09 9.874276998878613e-10 -7.077377940026459e-09 ] [ 2.019764090021422e-09 1.134711150325805e-10 1.376534236627294e-09 ] [ 3.73708385737547e-09 -8.686531078704071e-09 1.120597576473178e-10 ] [ 1.542296711556559e-09 3.807648682503026e-09 -3.062569743065939e-09 ] [ 2.428296217199745e-09 3.777983581280603e-09 8.651353688817786e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -12.683903 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.032185284709499e-18 } "relaxed-configuration-positions" { "source-value" [ [ 0.7866216 2.1030614 -0.0827572 ] [ 0.2074981 2.3358648 2.3565614 ] [ 2.5169044 0.3670788 0.4937027 ] [ 1.9377823 0.5998752 2.9330126 ] [ 2.6702717 2.7151628 1.6055387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 7.866216000000001e-11 2.1030614e-10 -8.27572e-12 ] [ 2.074981e-11 2.3358648e-10 2.3565614e-10 ] [ 2.5169044e-10 3.670788e-11 4.937027e-11 ] [ 1.9377823e-10 5.998752000000001e-11 2.9330126e-10 ] [ 2.6702717e-10 2.7151628e-10 1.6055387e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ -6.25e-05 1.66e-05 -3.74e-05 ] [ -3.9e-05 1.8e-06 -1.4e-06 ] [ 3.36e-05 -1.07e-05 -2.58e-05 ] [ -4.8e-06 -2.48e-05 6.22e-05 ] [ 7.26e-05 1.72e-05 2.4e-06 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.001360388e-13 2.659613190528e-14 -5.992140561792e-14 ] [ -6.248488821120001e-14 2.88391791744e-15 -2.24304726912e-15 ] [ 5.383313445888e-14 -1.714328984256e-14 -4.133615681664e-14 ] [ -7.69044777984e-15 -3.973398019584e-14 9.965538581376e-14 ] [ 1.1631802267008e-13 2.755743787776e-14 3.84522388992e-15 ] ] } "relaxed-potential-energy" { "source-value" -15.126158 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.423477671012689e-18 } }