{ "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" [ [ -1.1463717 -2.2655687 0.626907 ] [ 0.5072652 0.2344856 0.572454 ] [ 0.2703926 -0.0598104 0.6885916 ] [ -0.5651841 -0.0667597 0.7481494 ] [ -0.7233736 0.6989353 -0.106559 ] [ -0.8636399 1.6159337 0.9821485 ] [ 0.8950389 -0.8172887 -1.2775054 ] [ 1.6258728 0.660073 -2.2341862 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.836689951618858e-09 -3.629841233861756e-09 1.004415747091038e-09 ] [ 8.127284506813366e-10 3.756873493294703e-10 9.171724228398359e-10 ] [ 4.332167057265084e-10 -9.582682535019358e-11 1.103245371888674e-09 ] [ -9.055247589283193e-10 -1.069608314328498e-10 1.198667487421119e-09 ] [ -1.158972279572462e-09 1.11981780633778e-09 -1.70726339942406e-10 ] [ -1.383703667970096e-09 2.589011216233165e-09 1.573575377818149e-09 ] [ 1.434010412101062e-09 -1.309440858372236e-09 -2.046789301688823e-09 ] [ 2.604935410016155e-09 1.057553537334282e-09 -3.57956092564525e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -0.7336596015624792 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -1.175452270933154e-19 } }