{ "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" [ 5.47211 0 0 ] "si-unit" "m" "si-value" [ 5.47211e-10 0.0 0.0 ] } "unrelaxed-periodic-cell-vector-2" { "source-unit" "angstrom" "source-value" [ 0.102197 5.35978 0 ] "si-unit" "m" "si-value" [ 1.02197e-11 5.35978e-10 0.0 ] } "unrelaxed-periodic-cell-vector-3" { "source-unit" "angstrom" "source-value" [ 0.0185088 0.0167086 5.27242 ] "si-unit" "m" "si-value" [ 1.85088e-12 1.67086e-12 5.27242e-10 ] } "unrelaxed-configuration-positions" { "source-value" [ [ 0.0278677 0.000879346 0.114128 ] [ 1.32251 1.35955 1.26618 ] [ 0.0215185 2.57215 2.76138 ] [ 1.39174 4.08684 3.88021 ] [ 2.74481 0.155651 2.83937 ] [ 4.07982 1.36064 4.14567 ] [ 2.72904 2.76199 -0.16614 ] [ 4.049 4.11184 1.31405 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.78677e-12 8.79346e-14 1.14128e-11 ] [ 1.32251e-10 1.35955e-10 1.26618e-10 ] [ 2.15185e-12 2.57215e-10 2.76138e-10 ] [ 1.39174e-10 4.08684e-10 3.88021e-10 ] [ 2.74481e-10 1.55651e-11 2.83937e-10 ] [ 4.07982e-10 1.36064e-10 4.14567e-10 ] [ 2.72904e-10 2.76199e-10 -1.6614e-11 ] [ 4.049000000000001e-10 4.11184e-10 1.31405e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -1.0346424 -0.6608431 -0.7055729 ] [ 1.6879565 0.8323239 1.145314 ] [ -1.1091257 1.6756155 -1.65268 ] [ -0.3479046 0.0747386 0.4552669 ] [ -0.884469 -0.6830467 -2.3192535 ] [ 1.4588764 -0.2325709 -0.7258386 ] [ -0.7053567 0.1809718 2.4726502 ] [ 0.9346656 -1.187189 1.3301139 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.657679877825682e-09 -1.058787373560125e-09 -1.130452413963618e-09 ] [ 2.704404463508421e-09 1.333529904499753e-09 1.834995329393076e-09 ] [ -1.777015280708894e-09 2.684632001668227e-09 -2.64788527947912e-09 ] [ -5.574046209811164e-10 1.197444385778724e-10 7.294179894136144e-10 ] [ -1.417075565297346e-09 -1.094361462670808e-09 -3.715853766022719e-09 ] [ 2.337377679974038e-09 -3.726196617283506e-10 -1.162921644975272e-09 ] [ -1.130106023375347e-09 2.899487893729212e-10 3.961622374495427e-09 ] [ 1.49749938492359e-09 -1.902086475941826e-09 2.131077411138612e-09 ] ] } "unrelaxed-potential-energy" { "source-value" -34.71314329230348 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -5.561658707562246e-18 } }