{ "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" [ 5.34161 0 0 ] "si-unit" "m" "si-value" [ 5.341610000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.0977669 5.5284 0 ] "si-unit" "m" "si-value" [ -9.776690000000001e-12 5.5284e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.072801 -0.0524088 5.47046 ] "si-unit" "m" "si-value" [ -7.280100000000001e-12 -5.24088e-12 5.470460000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0796719 -0.127908 0.00668105 ] [ 1.22031 1.46092 1.38882 ] [ -0.251468 2.67688 2.66146 ] [ 1.14494 4.10147 3.98362 ] [ 2.6636 -0.086404 2.79747 ] [ 4.00012 1.38046 4.02333 ] [ 2.71061 2.85329 -0.00699576 ] [ 4.09739 4.08725 1.448 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -7.967190000000001e-12 -1.27908e-11 6.68105e-13 ] [ 1.22031e-10 1.46092e-10 1.38882e-10 ] [ -2.51468e-11 2.67688e-10 2.66146e-10 ] [ 1.14494e-10 4.10147e-10 3.98362e-10 ] [ 2.663600000000001e-10 -8.6404e-12 2.79747e-10 ] [ 4.00012e-10 1.38046e-10 4.02333e-10 ] [ 2.71061e-10 2.85329e-10 -6.99576e-13 ] [ 4.09739e-10 4.08725e-10 1.448e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 2.6035103 2.2440774 -1.2472614 ] [ 1.5089483 -1.7978048 -0.8811295 ] [ 4.7245335 -0.1725229 1.0532744 ] [ -0.2205462 -1.0472188 1.6040798 ] [ -0.070367 1.0459407 -2.2949916 ] [ -2.528565 -1.4195523 2.9101298 ] [ -0.9962237 -0.768702 -0.5149164 ] [ -5.0212901 1.9157827 -0.6291852 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 4.171283334671994e-09 3.59540834554565e-09 -1.998333055106277e-09 ] [ 2.417601688255905e-09 -2.88040081932202e-09 -1.411725084797194e-09 ] [ 7.569537117886397e-09 -2.764121569326164e-10 1.687531618967148e-09 ] [ -3.53353965446281e-10 -1.677829478222231e-09 2.57001915345754e-09 ] [ -1.127403622758336e-10 1.675781736283187e-09 -3.676981886452385e-09 ] [ -4.051207727173152e-09 -2.274373507062868e-09 4.662541929053379e-09 ] [ -1.596126321226873e-09 -1.231596372762202e-09 -8.249870177465012e-10 ] [ -8.044993604474494e-09 3.069422252473101e-09 -1.008065817593372e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -35.279385 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.652380584320221e-18 } }