{ "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" [ 5.33088 0 0 ] "si-unit" "m" "si-value" [ 5.33088e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0480326 5.46857 0 ] "si-unit" "m" "si-value" [ 4.80326e-12 5.46857e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.109209 0.182969 5.33745 ] "si-unit" "m" "si-value" [ -1.09209e-11 1.82969e-11 5.33745e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0970486 -0.0788825 -0.10937 ] [ 1.39157 1.38931 1.26283 ] [ -0.0444574 2.82173 2.6602 ] [ 1.24826 4.17435 3.90061 ] [ 2.67605 0.0682538 2.80056 ] [ 3.9766 1.50429 4.31462 ] [ 2.81042 2.80539 0.0255717 ] [ 4.1826 4.03217 1.44291 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -9.70486e-12 -7.88825e-12 -1.0937e-11 ] [ 1.39157e-10 1.38931e-10 1.26283e-10 ] [ -4.44574e-12 2.82173e-10 2.6602e-10 ] [ 1.24826e-10 4.17435e-10 3.90061e-10 ] [ 2.67605e-10 6.825380000000001e-12 2.80056e-10 ] [ 3.9766e-10 1.50429e-10 4.31462e-10 ] [ 2.81042e-10 2.80539e-10 2.55717e-12 ] [ 4.1826e-10 4.03217e-10 1.44291e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.9703642 -1.0737367 2.5047689 ] [ -0.7362586 -0.2412556 0.833193 ] [ 1.2675321 -3.0577625 1.0682506 ] [ 0.7065156 0.688375 1.8576612 ] [ 0.6841591 0.4145967 -1.2368915 ] [ -0.6400357 0.6500589 -4.7273841 ] [ -1.4620435 0.1157174 0.8022913 ] [ -2.7902332 2.5040068 -1.1018895 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.759048115710102e-09 -1.720315851808268e-09 4.013082205149882e-09 ] [ -1.179616325501552e-09 -3.865340851416503e-10 1.334922356212362e-09 ] [ 2.030810313464951e-09 -4.899075629821424e-09 1.71152615057648e-09 ] [ 1.13196278587649e-09 1.10289834042975e-09 2.9763013685284e-09 ] [ 1.096143723958469e-09 6.642571452735077e-10 -1.981718660093211e-09 ] [ -1.025450243465834e-09 1.041509180303743e-09 -7.574104344963118e-09 ] [ -2.342451933591579e-09 1.853997144272316e-10 1.285412374521484e-09 ] [ -4.470446436451048e-09 4.011861186337111e-09 -1.765421610149943e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.882134 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.588734003885695e-18 } }