{ "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" [ [ -2.4246888 -3.3411192 -3.7159848 ] [ 3.2946067 3.4958044 1.5749862 ] [ -0.4955281 0.185248 -0.5650092 ] [ 0.7979229 0.229804 2.0545766 ] [ 0.0736724 -1.0479099 -1.9044446 ] [ 0.0545802 0.2913669 0.2454697 ] [ -1.2012434 -0.0010345 0.4549356 ] [ -0.0993219 0.1878403 1.8554706 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.884779708075608e-09 -5.353063069545999e-09 -5.953663969808164e-09 ] [ 5.278541829471039e-09 5.600896080569771e-09 2.523406067722633e-09 ] [ -7.939235367694446e-10 2.968000146499584e-10 -9.052445307769114e-10 ] [ 1.278413415580936e-09 3.681865961663232e-10 3.291794594162753e-09 ] [ 1.180361968782259e-10 -1.678936742484866e-09 -3.051256613728808e-09 ] [ 8.744712039858816e-11 4.668212352549715e-10 3.932858144547898e-10 ] [ -1.924604091370303e-09 -1.6574517142176e-12 7.288871822896204e-10 ] [ -1.591312261134355e-10 3.009533371040583e-10 2.972791615901749e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.891377 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.750432511771884e-18 } }