{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 10.2290303 11.9841472 -9.9769 ] [ 2.4937069 -4.3978691 -2.0469573 ] [ 36.6902452 -8.8322352 13.1526121 ] [ -7.4228559 -9.3434995 4.7390169 ] [ 5.7325151 3.5977636 -10.901786 ] [ -12.6318829 -11.9462128 18.1908547 ] [ -0.0638282 -0.6985495 -1.0160486 ] [ -35.0269305 19.6364552 -12.1407917 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.638871333513801e-08 1.920072062225653e-08 -1.59847560597546e-08 ] [ 3.995358927224574e-09 -7.04616311141061e-09 -3.279587156855728e-09 ] [ 5.878425355517065e-08 -1.415080086343232e-08 2.107280778268567e-08 ] [ -1.189272628052904e-08 -1.496993657869068e-08 7.592742145311114e-09 ] [ 9.184501747272173e-09 5.764252774575722e-09 -1.746658679806832e-08 ] [ -2.023850762580416e-08 -1.913994301295171e-08 2.914496235282908e-08 ] [ -1.022640506302788e-10 -1.119199686592383e-09 -1.627889325928412e-09 ] [ -5.611932960784193e-08 3.14610696960278e-08 -1.945169278000113e-08 ] ] } "unrelaxed-potential-energy" { "source-value" -28.291202 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -4.532750279217406e-18 } }