{ "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" [ [ 1.1361686 2.3173655 -0.6004337 ] [ -0.5759649 -0.4224155 -0.5246757 ] [ 0.2782157 0.2730712 -0.4166751 ] [ -0.0506481 -0.022278 -0.8063579 ] [ 1.0101599 -0.0773576 0.2077429 ] [ 0.5156509 -2.1978872 -1.1399695 ] [ -0.5552919 0.8437356 1.6117675 ] [ -1.7582902 -0.714234 1.6686014 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.820342768207067e-09 3.712828825948503e-09 -9.62000836480441e-10 ] [ -9.227974971814099e-10 -6.767842383635425e-10 -8.406231400418744e-10 ] [ 4.457506900795066e-10 4.37508292453801e-10 -6.675871036895021e-10 ] [ -8.114720170794049e-11 -3.56932907581824e-11 -1.291927775377384e-09 ] [ 1.618454575049666e-09 -1.239405381611981e-10 3.328408175171923e-10 ] [ 8.261638164744787e-10 -3.521403486995574e-09 -1.826432481325066e-09 ] [ -8.896756998996114e-10 1.351813452456661e-09 2.582336206665264e-09 ] [ -2.817091451021756e-09 -1.144329016580467e-09 2.673394152514149e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -41.507715 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -6.650269055582947e-18 } }