{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-periodic-cell-vector-1" { "source-unit" "angstrom" "source-value" [ 5.41852 0 0 ] "si-unit" "m" "si-value" [ 5.418520000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.038783 5.47951 0 ] "si-unit" "m" "si-value" [ 3.8783e-12 5.479510000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.00323821 0.0198894 5.39896 ] "si-unit" "m" "si-value" [ 3.23821e-13 1.98894e-12 5.39896e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0136142 -0.0297439 -0.141562 ] [ 1.34075 1.30471 1.3715 ] [ -0.0280615 2.73239 2.73273 ] [ 1.33689 4.08129 3.93514 ] [ 2.80172 0.157681 2.72105 ] [ 4.07194 1.39009 4.01929 ] [ 2.65272 2.79754 0.0144035 ] [ 4.02421 4.07244 1.32124 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.36142e-12 -2.97439e-12 -1.41562e-11 ] [ 1.34075e-10 1.30471e-10 1.3715e-10 ] [ -2.80615e-12 2.73239e-10 2.73273e-10 ] [ 1.33689e-10 4.08129e-10 3.93514e-10 ] [ 2.80172e-10 1.57681e-11 2.72105e-10 ] [ 4.07194e-10 1.39009e-10 4.01929e-10 ] [ 2.65272e-10 2.79754e-10 1.44035e-12 ] [ 4.02421e-10 4.072440000000001e-10 1.32124e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.0288525 -0.4468843 1.4803499 ] [ -0.6599533 0.7222634 -0.8147884 ] [ -0.0396783 -0.3604271 -1.57188 ] [ 1.3656814 1.1545999 0.1580458 ] [ -1.2975677 -2.6105788 -0.9657145 ] [ 0.040822 1.5819498 1.8950106 ] [ -0.3820837 -1.2775804 -0.5320858 ] [ 0.9439272 1.2366575 0.3510624 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.6226800951632e-11 -7.159875776625735e-10 2.371782000383618e-09 ] [ -1.057361748079809e-09 1.157193533539519e-09 -1.305434925379039e-09 ] [ -6.357164461308864e-11 -5.774678731227437e-10 -2.518429386703104e-09 ] [ 2.188062810541413e-09 1.849872966158018e-09 2.532172857756326e-10 ] [ -2.078932632845228e-09 -4.182608320116119e-09 -1.547245194267562e-09 ] [ 6.54040540142976e-11 2.534562984839236e-09 3.03614167948818e-09 ] [ -6.12165571328761e-10 -2.046909448072312e-09 -8.524954290196647e-10 ] [ 1.512338091577206e-09 1.981343734436976e-09 5.624639697219379e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -36.455501 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.840815140175102e-18 } }