{ "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" [ 5.36644 0 0 ] "si-unit" "m" "si-value" [ 5.366440000000001e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ -0.227231 5.37948 0 ] "si-unit" "m" "si-value" [ -2.27231e-11 5.379480000000001e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ -0.0350261 -0.0899265 5.39939 ] "si-unit" "m" "si-value" [ -3.50261e-12 -8.992650000000001e-12 5.399390000000001e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ -0.00104229 0.0077963 0.00224549 ] [ 1.32493 1.37357 1.36608 ] [ -0.0958533 2.66355 2.80902 ] [ 1.19786 4.07015 4.22336 ] [ 2.70129 0.113781 2.60003 ] [ 3.9906 1.45175 3.98519 ] [ 2.48193 2.86985 0.00162227 ] [ 4.00824 4.16333 1.43322 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ -1.04229e-13 7.7963e-13 2.24549e-13 ] [ 1.32493e-10 1.37357e-10 1.36608e-10 ] [ -9.58533e-12 2.66355e-10 2.80902e-10 ] [ 1.19786e-10 4.07015e-10 4.22336e-10 ] [ 2.70129e-10 1.13781e-11 2.60003e-10 ] [ 3.9906e-10 1.45175e-10 3.98519e-10 ] [ 2.48193e-10 2.86985e-10 1.62227e-13 ] [ 4.00824e-10 4.16333e-10 1.43322e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ 0.4903772 2.6320996 -0.6955637 ] [ -1.492297 0.9976524 -0.536949 ] [ 2.6618952 2.8311691 -2.5110504 ] [ -1.1013728 1.324208 -3.7733796 ] [ 0.4880326 -1.5478541 1.9073106 ] [ -2.5617793 -2.4762926 3.2712222 ] [ 3.6694375 -1.9059171 1.9237476 ] [ -2.1542934 -1.8550654 0.4146624 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 7.856708852133657e-10 4.217088442737032e-09 -1.114415898417145e-09 ] [ -2.390923364689978e-09 1.59841535096501e-09 -8.602871343619392e-10 ] [ 4.26482625645974e-09 4.536032941551377e-09 -4.023146244530488e-09 ] [ -1.764593750945034e-09 2.121615098676327e-09 -6.045620576523656e-09 ] [ 7.819144219082381e-10 -2.479935651429425e-09 3.05584845192402e-09 ] [ -4.10442290210939e-09 -3.967458109980046e-09 5.241075730281942e-09 ] [ 5.879086973986801e-09 -3.053615818802935e-09 3.08218342904011e-09 ] [ -3.451558519823742e-09 -2.972142413935001e-09 6.643624028048179e-10 ] ] } "unrelaxed-potential-energy" { "source-value" -35.439107 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.677970869742963e-18 } }