{ "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" [ 4.68891 4.374736 4.180023 4.038554 3.927376 3.835779 3.757886 3.690126 3.630163 3.576387 3.52764 3.48306 3.441992 3.403921 3.368441 3.335221 3.30399 3.274523 3.246632 3.220156 3.19496 3.170924 3.147948 3.12594 3.110958 3.09519 3.078548 3.060932 3.042219 3.022263 3.000888 2.977876 2.952955 2.925781 2.895904 2.862728 2.825431 2.782843 2.733212 2.673735 2.599516 2.50075 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.68891e-10 4.3747360000000005e-10 4.1800230000000007e-10 4.0385540000000007e-10 3.9273760000000004e-10 3.8357790000000004e-10 3.757886e-10 3.690126e-10 3.630163e-10 3.576387e-10 3.52764e-10 3.4830600000000003e-10 3.441992e-10 3.403921e-10 3.368441e-10 3.3352210000000005e-10 3.30399e-10 3.274523e-10 3.2466320000000003e-10 3.220156e-10 3.19496e-10 3.170924e-10 3.147948e-10 3.12594e-10 3.1109580000000005e-10 3.09519e-10 3.078548e-10 3.060932e-10 3.042219e-10 3.022263e-10 3.000888e-10 2.977876e-10 2.952955e-10 2.9257810000000005e-10 2.895904e-10 2.8627280000000005e-10 2.825431e-10 2.782843e-10 2.733212e-10 2.673735e-10 2.599516e-10 2.50075e-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 0 0.00142426 0.259283 0.880253 1.73756 2.33246 2.71901 3.03548 3.28926 3.48829 3.64042 3.75289 3.83219 3.88618 3.93163 3.96412 3.98162 3.9868 3.98463 3.97812 3.96722 3.95184 3.93164 3.90588 3.87308 3.83074 3.77485 3.69933 3.59536 3.45051 3.24768 2.96267 2.53922 1.87304 0.74302 -1.42757 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 0.0 0.0 0.0 2.281916073940608e-22 4.154171607708864e-20 1.4103207769890625e-19 2.783878009237248e-19 3.7370128809511684e-19 4.356334253721408e-19 4.863375088905984e-19 5.269975471732609e-19 5.588856684570433e-19 5.832595813892737e-19 6.012792618434112e-19 6.139845224463553e-19 6.226346740220544e-19 6.299165667635905e-19 6.351220386045696e-19 6.379258476909696e-19 6.387557751805441e-19 6.384081028538305e-19 6.373650858736897e-19 6.356187133570177e-19 6.331545657142272e-19 6.299181689402112e-19 6.257909619650304e-19 6.205358226488064e-19 6.137522068363392e-19 6.04797641702688e-19 5.926980038624064e-19 5.760401735359488e-19 5.528326451836608e-19 5.203356967839744e-19 4.746720609145537e-19 4.068278919067776e-19 3.0009408978232325e-19 1.190449272786816e-19 -2.287219278555456e-19 ] } }