{ "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" [ [ -1.7323114 -2.4197789 -2.6645378 ] [ 2.1878106 2.4612134 0.8386826 ] [ -0.197412 0.3006139 -0.1787421 ] [ 0.6910831 0.093732 1.5894946 ] [ 0.0158114 -0.7180775 -1.5012421 ] [ -0.1749284 0.0206144 -0.0321705 ] [ -0.7206427 0.2514185 0.5302113 ] [ -0.0694107 0.0102641 1.4183039 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -2.775468825025317e-09 -3.876913181085141e-09 -4.269060168397867e-09 ] [ 3.505258994058421e-09 3.943298568279679e-09 1.343717653991758e-09 ] [ -3.162888910653696e-10 4.816365624675091e-10 -2.863764137726957e-10 ] [ 1.107237185849988e-09 1.501752190208256e-10 2.546651087007848e-09 ] [ 2.533265542211712e-11 -1.150486982422512e-09 -2.405254994780696e-09 ] [ -2.802661927939507e-10 3.302790973181952e-11 -5.15428229794464e-11 ] [ -1.154596885890188e-09 4.028168427366048e-10 8.494921489439751e-10 ] [ -1.112082007733626e-10 1.644490105355328e-11 2.272373349769461e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.093582 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.78282932413277e-18 } }