{ "unrelaxed-periodic-cell-vector-1" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 5.42981e-10 0.0 0.0 ] "source-value" [ 5.42981 0 0 ] } "unrelaxed-periodic-cell-vector-2" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 3.70196e-12 5.47054e-10 0.0 ] "source-value" [ 0.0370196 5.47054 0 ] } "unrelaxed-periodic-cell-vector-3" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ -3.39139e-12 -1.43321e-12 5.52419e-10 ] "source-value" [ -0.0339139 -0.0143321 5.52419 ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-nonorthogonal-periodic-3d-cell-fixed-particles-fixed" "unrelaxed-configuration-forces" { "si-unit" "kg m / s^2" "source-unit" "eV/angstrom" "si-value" [ [ -6.289845485797387e-09 -2.109632579947025e-09 -7.18413913937113e-10 ] [ 3.639944369509352e-09 2.091057104423132e-09 5.888741850521403e-09 ] [ 7.404167656882215e-10 1.101498189194283e-09 -1.754336616218673e-09 ] [ 2.274684489544965e-09 -6.909792027885063e-10 -4.36761742235573e-09 ] [ -2.733670600471239e-09 -1.738405372989748e-09 -2.700399960981368e-09 ] [ 1.141786362283258e-10 1.391119651494747e-09 4.257569037238165e-09 ] [ 4.185349964749632e-10 -2.074406804326792e-09 -2.482831906106845e-09 ] [ 1.835756828822798e-09 2.02974901493991e-09 1.877289092057823e-09 ] ] "source-value" [ [ -3.9258128 -1.3167291 -0.4483987 ] [ 2.2718746 1.3051352 3.6754636 ] [ 0.4621318 0.6875011 -1.0949708 ] [ 1.4197464 -0.4312753 -2.7260524 ] [ -1.706223 -1.0850273 -1.6854571 ] [ 0.0712647 0.8682686 2.6573656 ] [ 0.261229 -1.2947429 -1.5496618 ] [ 1.1457893 1.2668697 1.1717117 ] ] } "instance-id" 1 "unrelaxed-configuration-positions" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ [ 8.65271e-12 2.02603e-12 -4.850630000000001e-12 ] [ 1.27669e-10 1.31148e-10 1.22292e-10 ] [ -1.37625e-12 2.6467e-10 2.79128e-10 ] [ 1.29807e-10 4.019929999999999e-10 4.311e-10 ] [ 2.70854e-10 -6.97941e-12 2.82717e-10 ] [ 4.06866e-10 1.27154e-10 4.01384e-10 ] [ 2.71531e-10 2.7055e-10 6.03487e-12 ] [ 4.06455e-10 4.016510000000001e-10 1.33765e-10 ] ] "source-value" [ [ 0.0865271 0.0202603 -0.0485063 ] [ 1.27669 1.31148 1.22292 ] [ -0.0137625 2.6467 2.79128 ] [ 1.29807 4.01993 4.311 ] [ 2.70854 -0.0697941 2.82717 ] [ 4.06866 1.27154 4.01384 ] [ 2.71531 2.7055 0.0603487 ] [ 4.06455 4.01651 1.33765 ] ] } "unrelaxed-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" -5.726319433193521e-18 "source-value" -35.740875 } }