{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "bcc" ] } "species" { "source-value" [ "Si" "Si" ] } "a" { "source-value" [ 4.55973 4.254211 4.064863 3.927291 3.819177 3.730102 3.654356 3.588462 3.530152 3.477857 3.430453 3.387101 3.347164 3.310143 3.27564 3.243335 3.212964 3.184309 3.157187 3.131441 3.106938 3.083565 3.061221 3.03982 3.025251 3.009917 2.993735 2.976604 2.958406 2.939 2.918214 2.895836 2.871603 2.845177 2.816124 2.783862 2.747593 2.706179 2.657915 2.600077 2.527904 2.43186 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.55973e-10 4.254211e-10 4.064863e-10 3.927291e-10 3.819177e-10 3.730102e-10 3.6543560000000003e-10 3.588462e-10 3.530152e-10 3.477857e-10 3.430453e-10 3.387101e-10 3.347164e-10 3.310143e-10 3.2756400000000004e-10 3.2433350000000004e-10 3.212964e-10 3.184309e-10 3.157187e-10 3.1314410000000003e-10 3.106938e-10 3.0835650000000003e-10 3.061221e-10 3.0398200000000004e-10 3.025251e-10 3.0099170000000004e-10 2.993735e-10 2.976604e-10 2.958406e-10 2.9390000000000004e-10 2.918214e-10 2.895836e-10 2.871603e-10 2.845177e-10 2.816124e-10 2.7838620000000004e-10 2.747593e-10 2.7061790000000005e-10 2.6579150000000003e-10 2.600077e-10 2.527904e-10 2.43186e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0.0185392 0.238865 0.77497 1.45918 2.11234 2.65696 3.07982 3.3942 3.62151 3.78343 3.89869 3.98205 4.04409 4.09167 4.12871 4.1569 4.17673 4.18844 4.1923 4.1904 4.18413 4.17239 4.15377 4.12647 4.08815 4.03584 3.96569 3.87272 3.75026 3.58898 3.37486 3.08526 2.68127 2.09411 1.19501 -0.291512 -3.07487 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 2.970307280833536e-21 3.82703918527392e-20 1.2416388158213762e-19 2.337864081538944e-19 3.3843417631806724e-19 4.2569191944007686e-19 4.934415600272256e-19 5.43810788631936e-19 5.802298653993408e-19 6.061723092433344e-19 6.2463899697467525e-19 6.37994741285664e-19 6.479346450411072e-19 6.555578014028736e-19 6.614922636063168e-19 6.660087995003521e-19 6.691859157393985e-19 6.710620645623552e-19 6.716805047379841e-19 6.713760911800321e-19 6.703715264387904e-19 6.684905710859713e-19 6.6550731821804155e-19 6.611333760432577e-19 6.54993835232352e-19 6.466128493289473e-19 6.353735803340352e-19 6.204781442904577e-19 6.008578893921408e-19 5.750179848518784e-19 5.407121790473089e-19 4.943131441089408e-19 4.2958681080524164e-19 3.3551340833834884e-19 1.914617083622208e-19 -4.6705371108264963e-20 -4.926484825999297e-19 ] } }