{ "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" [ 5.45189 0 0 ] "si-unit" "m" "si-value" [ 5.451889999999999e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.103872 5.48254 0 ] "si-unit" "m" "si-value" [ 1.03872e-11 5.482540000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0133572 0.0848103 5.46172 ] "si-unit" "m" "si-value" [ -1.33572e-12 8.481030000000001e-12 5.46172e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0515087 0.139447 0.129479 ] [ 1.28089 1.29793 1.3896 ] [ -0.0267641 2.78569 2.67144 ] [ 1.28772 4.21003 3.97686 ] [ 2.71226 0.0930415 2.84614 ] [ 4.11731 1.46571 4.11351 ] [ 2.72029 2.73709 -0.0733662 ] [ 4.08924 4.18171 1.22387 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 5.15087e-12 1.39447e-11 1.29479e-11 ] [ 1.28089e-10 1.29793e-10 1.3896e-10 ] [ -2.67641e-12 2.78569e-10 2.67144e-10 ] [ 1.28772e-10 4.21003e-10 3.97686e-10 ] [ 2.71226e-10 9.304150000000001e-12 2.84614e-10 ] [ 4.11731e-10 1.46571e-10 4.11351e-10 ] [ 2.72029e-10 2.73709e-10 -7.336620000000001e-12 ] [ 4.089240000000001e-10 4.18171e-10 1.22387e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -5.2335116 -5.7428717 -6.3854832 ] [ 5.7015533 5.6560846 4.4240717 ] [ -0.1315639 0.1025598 -0.4427507 ] [ 0.5850635 0.2916548 1.9939891 ] [ -0.0461558 -0.5103586 -1.9123123 ] [ 0.1598686 -0.2280542 0.0955919 ] [ -1.0737619 0.20185 0.7623464 ] [ 0.0385078 0.2291355 1.4645471 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -8.385009999287953e-09 -9.201094849799857e-09 -1.023067197983955e-08 ] [ 9.13489547476559e-09 9.062046586047235e-09 7.088144304880657e-09 ] [ -2.107886064579126e-10 1.643189151477132e-10 -7.093648262271437e-10 ] [ 9.37375069106259e-10 4.672825057539431e-10 3.194722744470689e-09 ] [ -7.394974428357718e-11 -8.176846238809523e-10 -3.063862083970798e-09 ] [ 2.561377354302924e-10 -3.653831105255628e-10 1.531551085796646e-10 ] [ -1.720356226659445e-09 3.233993535728999e-10 1.221413589094017e-09 ] [ 6.16962973867452e-11 3.671155441199069e-10 2.346463143012462e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.60296 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.704223061323664e-18 } }