{ "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" [ [ -2.1907003 -2.5866682 -2.7422082 ] [ 2.4716454 2.6026047 1.4402726 ] [ -0.209856 0.2303476 -0.256796 ] [ 0.8587094 0.1127358 1.2226023 ] [ -0.1302155 -0.7568274 -1.2901734 ] [ -0.2295604 0.1814477 0.0707596 ] [ -0.4950275 0.2592119 0.3124998 ] [ -0.074995 -0.0428522 1.2430433 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -3.50988883275679e-09 -4.144299349950838e-09 -4.393501903603197e-09 ] [ 3.960012507413582e-09 4.169832437878579e-09 2.307571106310428e-09 ] [ -3.36226379704704e-10 3.690575424179784e-10 -4.11432550904664e-10 ] [ 1.375804136076159e-09 1.806226645752972e-10 1.958824837734658e-09 ] [ -2.08628231484627e-10 -1.212571176250971e-09 -2.067085675288335e-09 ] [ -3.677963089716935e-10 2.907112652330418e-10 1.133693777511864e-10 ] [ -7.93121493687435e-10 4.153032494347445e-10 5.006798776896731e-10 ] [ -1.2015523666683e-10 -6.86567935554948e-11 1.991574930310252e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -36.142981 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.790743964130595e-18 } }