{ "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" [ 5.55975 0 0 ] "si-unit" "m" "si-value" [ 5.55975e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.00335003 5.48819 0 ] "si-unit" "m" "si-value" [ 3.35003e-13 5.488190000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0164792 -0.0422926 5.51812 ] "si-unit" "m" "si-value" [ 1.64792e-12 -4.22926e-12 5.51812e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.0695878 -0.00317054 -0.0200442 ] [ 1.39636 1.32374 1.28539 ] [ -0.0674176 2.58156 2.68412 ] [ 1.50658 3.99879 4.14654 ] [ 2.80481 -0.0668971 2.57568 ] [ 4.18687 1.32364 3.96453 ] [ 2.74594 2.77319 -0.0797703 ] [ 4.04367 4.06467 1.27465 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -6.958780000000001e-12 -3.17054e-13 -2.00442e-12 ] [ 1.39636e-10 1.32374e-10 1.28539e-10 ] [ -6.74176e-12 2.58156e-10 2.68412e-10 ] [ 1.50658e-10 3.99879e-10 4.14654e-10 ] [ 2.80481e-10 -6.689710000000001e-12 2.57568e-10 ] [ 4.18687e-10 1.32364e-10 3.96453e-10 ] [ 2.74594e-10 2.77319e-10 -7.97703e-12 ] [ 4.04367e-10 4.06467e-10 1.27465e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.5625865 -0.6437548 -1.0853359 ] [ -0.3666204 0.1331711 -0.0438726 ] [ 1.3636791 2.1978817 -0.409221 ] [ -2.413362 1.2240672 -1.7701657 ] [ -0.8484108 0.1270186 1.5971785 ] [ -0.9718494 -0.7600829 1.5295126 ] [ 0.6858628 -1.8585919 -0.1411947 ] [ 1.9881142 -0.4197091 0.3230988 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 9.013629449038409e-10 -1.031408898585343e-09 -1.73889981902136e-09 ] [ -5.873906384277336e-10 2.133636247440774e-10 -7.029165459282839e-11 ] [ 2.184854790294149e-09 3.521394704036197e-09 -6.55644324342114e-10 ] [ -3.866632205783507e-09 1.961171866285804e-09 -2.836118122848254e-09 ] [ -1.359303959793247e-09 2.035062330033924e-10 2.558962073027169e-09 ] [ -1.557074400446919e-09 -1.217787062282959e-09 2.450549349128588e-09 ] [ 1.098873352289815e-09 -2.977792514321664e-09 -2.262188491846398e-10 ] [ 3.185310116963603e-09 -6.724481130971693e-10 5.176613478334392e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -34.59217929230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.542278138126728e-18 } }