{ "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" [ [ -0.6915905 -2.7877401 -2.1190483 ] [ 3.7900803 2.7701327 1.3623785 ] [ -0.5248111 1.0866215 -0.5707371 ] [ -0.9183039 -0.3931658 0.6021633 ] [ 1.8525539 -0.9637929 0.1315335 ] [ -0.027279 0.0421959 -0.3245979 ] [ -1.5756226 0.4717701 1.0884567 ] [ -1.9050271 -0.2260214 -0.1701487 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.108050139396377e-09 -4.466452049884824e-09 -3.395089672577422e-09 ] [ 6.07237809764371e-09 4.438241885019331e-09 2.182770999363969e-09 ] [ -8.408400816838373e-10 1.740959577302031e-09 -9.144216457769213e-10 ] [ -1.471285051491072e-09 -6.299210580479171e-10 9.64771969112332e-10 ] [ 2.968118571805572e-09 -1.544166464395098e-09 2.10739900288239e-10 ] [ -4.3705776398886e-11 6.76052850306006e-11 -5.200631708254686e-10 ] [ -2.524425713722328e-09 7.558590308398433e-10 1.743899891860748e-09 ] [ -3.052189906756781e-09 -3.621262058639676e-10 -2.726082714454758e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -326.59388 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.232610833433999e-17 } }