{ "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" [ 5.47225 0 0 ] "si-unit" "m" "si-value" [ 5.47225e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0720088 5.55574 0 ] "si-unit" "m" "si-value" [ -7.20088e-12 5.55574e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0610026 -0.0268755 5.37267 ] "si-unit" "m" "si-value" [ -6.10026e-12 -2.68755e-12 5.37267e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0205094 -0.0758047 0.142316 ] [ 1.30951 1.38319 1.48801 ] [ -0.0602099 2.69484 2.70363 ] [ 1.30902 4.05591 4.11478 ] [ 2.76224 0.0853385 2.86654 ] [ 4.01949 1.17816 4.04456 ] [ 2.72232 2.71295 0.0698342 ] [ 4.15368 4.12703 1.42088 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.05094e-12 -7.580470000000001e-12 1.42316e-11 ] [ 1.30951e-10 1.38319e-10 1.48801e-10 ] [ -6.02099e-12 2.69484e-10 2.70363e-10 ] [ 1.30902e-10 4.05591e-10 4.11478e-10 ] [ 2.76224e-10 8.53385e-12 2.86654e-10 ] [ 4.01949e-10 1.17816e-10 4.04456e-10 ] [ 2.72232e-10 2.71295e-10 6.983420000000001e-12 ] [ 4.15368e-10 4.127030000000001e-10 1.42088e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.31326300000000007 0.16031370000000003 -0.33193720000000004 ] [ 0.3237244000000001 -0.18477400000000002 -0.29165700000000006 ] [ -0.23917080000000004 0.13231150000000003 0.4989877000000001 ] [ -0.017052100000000004 0.11206170000000003 -0.08722770000000002 ] [ -0.6757251000000001 -0.9504434000000003 -0.8164673000000002 ] [ 0.7768084000000002 0.7332196000000001 0.7874519000000002 ] [ 0.22319360000000005 -0.016632500000000005 0.05725050000000002 ] [ -0.7050413000000001 0.013943300000000004 0.18359910000000002 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 5.019026547616706e-10 2.56850862133945e-10 -5.318220214138138e-10 ] [ 5.186636652625077e-10 -2.960405829316993e-10 -4.672860266926657e-10 ] [ -3.831938641380327e-10 2.119863919629792e-10 7.994664270067643e-10 ] [ -2.732047595554369e-11 1.795426358271034e-10 -1.397541816261562e-10 ] [ -1.082630957307742e-09 -1.522778194873663e-09 -1.3081248197077e-09 ] [ 1.244584257321055e-09 1.174747301032328e-09 1.26163702418454e-09 ] [ 3.575955678321869e-10 -2.664820264545601e-11 9.172541262911044e-11 ] [ -1.129600687558439e-09 2.233962927680065e-11 2.941581856199213e-10 ] ] } "unrelaxed-potential-energy" { "source-value" 147.94568 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.370351096443582e-17 } }