{ "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" [ 5.40534 0 0 ] "si-unit" "m" "si-value" [ 5.40534e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.0241155 5.39517 0 ] "si-unit" "m" "si-value" [ 2.41155e-12 5.395170000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0520891 0.00914509 5.32386 ] "si-unit" "m" "si-value" [ -5.20891e-12 9.14509e-13 5.32386e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0541257 0.0304247 -0.104173 ] [ 1.34 1.36746 1.32858 ] [ -0.0983731 2.60813 2.63031 ] [ 1.3236 4.08084 4.09012 ] [ 2.69861 0.0115312 2.71277 ] [ 4.03614 1.39677 4.05029 ] [ 2.56533 2.8449 0.01686 ] [ 4.17154 4.11014 1.29552 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -5.41257e-12 3.04247e-12 -1.04173e-11 ] [ 1.34e-10 1.36746e-10 1.32858e-10 ] [ -9.837310000000001e-12 2.60813e-10 2.63031e-10 ] [ 1.3236e-10 4.08084e-10 4.09012e-10 ] [ 2.69861e-10 1.15312e-12 2.71277e-10 ] [ 4.03614e-10 1.39677e-10 4.05029e-10 ] [ 2.56533e-10 2.8449e-10 1.686e-12 ] [ 4.17154e-10 4.11014e-10 1.29552e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 1.1837928 -3.9318693 3.3590797 ] [ 3.7020399 2.9478644 2.799501 ] [ -2.4352305 -1.0556464 -6.1827934 ] [ 1.6469783 7.3113778 -3.3799916 ] [ -1.6721868 1.8900955 -0.6469398 ] [ -2.6003914 -0.2643465 -6.847181 ] [ 0.5226124 -5.1615276 7.7414454 ] [ -0.3476146 -1.7359479 3.1568797 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.89664514803137e-09 -6.299549068501261e-09 5.381838962743878e-09 ] [ 5.93132177704877e-09 4.722999422968619e-09 4.48529505210622e-09 ] [ -3.901669373359095e-09 -1.691331981911685e-09 -9.905927036716545e-09 ] [ 2.638750127224929e-09 1.171411857699614e-08 -5.415343520020385e-09 ] [ -2.679138596570365e-09 3.028266821179286e-09 -1.036511822625028e-09 ] [ -4.166286306009381e-09 -4.235297820903072e-10 -1.097039331658597e-08 ] [ 8.373173690201779e-10 -8.269678848333934e-09 1.24031628310797e-08 ] [ -5.569399851687437e-10 -2.781295140306856e-09 5.057878850018118e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -18.544531 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.971161401190084e-18 } }