{ "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" [ 5.51396 0 0 ] "si-unit" "m" "si-value" [ 5.51396e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0181329 5.46551 0 ] "si-unit" "m" "si-value" [ 1.81329e-12 5.46551e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.147171 -0.00272143 5.46493 ] "si-unit" "m" "si-value" [ 1.47171e-11 -2.72143e-13 5.46493e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0812176 -0.117418 -0.0378641 ] [ 1.41633 1.35692 1.32004 ] [ 0.0825096 2.73802 2.72856 ] [ 1.5042 4.09281 4.08646 ] [ 2.79856 -0.0135645 2.62504 ] [ 4.22175 1.43085 4.07963 ] [ 2.7526 2.68069 -0.168753 ] [ 4.2604 4.00574 1.18537 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -8.12176e-12 -1.17418e-11 -3.78641e-12 ] [ 1.41633e-10 1.35692e-10 1.32004e-10 ] [ 8.25096e-12 2.73802e-10 2.72856e-10 ] [ 1.5042e-10 4.09281e-10 4.08646e-10 ] [ 2.79856e-10 -1.35645e-12 2.62504e-10 ] [ 4.22175e-10 1.43085e-10 4.07963e-10 ] [ 2.7526e-10 2.68069e-10 -1.68753e-11 ] [ 4.2604e-10 4.00574e-10 1.18537e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 4.8443248 8.3931483 -4.1736852 ] [ -1.5243099 -0.3439338 -2.0428018 ] [ 0.6545437 1.0805623 -0.9997202 ] [ -0.1572777 -0.518439 -1.9343646 ] [ 2.6672964 -0.6458588 0.9405812 ] [ 3.4396597 -7.2417919 -4.0385377 ] [ -3.1667357 4.2660876 6.2836374 ] [ -6.7575015 -4.9897747 5.9648909 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.761464002066722e-09 1.344730609195682e-08 -6.686980905111617e-09 ] [ -2.442213704754876e-09 -5.510426980028291e-10 -3.27292931185314e-09 ] [ 1.048694622071906e-09 1.731251668641298e-09 -1.601728344977807e-09 ] [ -2.519866559892618e-10 -8.306308519543259e-10 -3.099193763756756e-09 ] [ 4.273479968032317e-09 -1.034779878223279e-09 1.506977221019681e-09 ] [ 5.510942400251449e-09 -1.160262977047046e-08 -6.470450738468101e-09 ] [ -5.073669944593633e-09 6.835025871317137e-09 1.006749701880851e-08 ] [ -1.082671100751995e-08 -7.994500433264358e-09 9.556808824339231e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.962928 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.601678629782434e-18 } }