{ "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" [ [ -2.1581583 -2.8389349 -3.1048042 ] [ 3.0084538 2.8408944 1.9366725 ] [ -0.4863367 0.191616 -0.5565765 ] [ 0.3642653 0.1620736 1.3038815 ] [ 0.2486628 -0.7661381 -1.1190415 ] [ 0.2176672 0.1528763 0.1911506 ] [ -0.9559981 0.1043667 0.2314552 ] [ -0.2385561 0.153246 1.1172624 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.457750800733162e-09 -4.548475162227126e-09 -4.974444742385062e-09 ] [ 4.820074382828509e-09 4.551614627341449e-09 3.102891427210365e-09 ] [ -7.791972969966677e-10 3.07002677900544e-10 -8.91733863333501e-10 ] [ 5.836173522370001e-10 2.596705349082624e-10 2.089048472804871e-09 ] [ 3.984017279050152e-10 -1.227488562237155e-09 -1.792902143776311e-09 ] [ 3.487413018282047e-10 2.449348357523742e-10 3.062570248950804e-10 ] [ -1.531677817968395e-09 1.672138881076878e-10 3.708321132577968e-10 ] [ -3.822090093181673e-10 2.45527160453964e-10 1.790051711326762e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.219342 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.802978345125482e-18 } }