{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Si" "Si" "Si" "Si" ] } "a" { "source-value" [ 5.98951 5.588191 5.33947 5.158761 5.016745 4.899741 4.800242 4.713687 4.637092 4.5684 4.506131 4.449186 4.396727 4.348097 4.302775 4.26034 4.220446 4.182806 4.147179 4.11336 4.081174 4.050472 4.021122 3.99301 3.973872 3.95373 3.932473 3.909971 3.886067 3.860576 3.833272 3.803877 3.772044 3.737332 3.699169 3.65679 3.609148 3.554748 3.49135 3.415376 3.32057 3.19441 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.98951e-10 5.588191000000001e-10 5.339470000000001e-10 5.158761000000001e-10 5.016745000000001e-10 4.899741e-10 4.800242e-10 4.713687e-10 4.637092e-10 4.5684e-10 4.506131e-10 4.449186e-10 4.3967270000000003e-10 4.3480970000000003e-10 4.3027749999999997e-10 4.2603400000000006e-10 4.220446e-10 4.1828060000000006e-10 4.1471790000000004e-10 4.11336e-10 4.081174e-10 4.050472e-10 4.021122e-10 3.99301e-10 3.973872e-10 3.9537300000000003e-10 3.932473e-10 3.909971e-10 3.8860670000000005e-10 3.860576e-10 3.833272e-10 3.803877e-10 3.772044e-10 3.737332e-10 3.699169e-10 3.65679e-10 3.609148e-10 3.554748e-10 3.49135e-10 3.4153760000000005e-10 3.32057e-10 3.19441e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0.000910864 0.820115 1.9152 2.63352 3.02111 3.19781 3.32907 3.44591 3.54955 3.64099 3.72112 3.79067 3.85031 3.9006 3.94207 3.97517 4.00032 4.01788 4.02819 4.03156 4.02992 4.02451 4.01445 3.99861 3.97556 3.94341 3.89965 3.84093 3.76262 3.6582 3.51829 3.32886 3.06813 2.7006 1.90157 0.147128 -2.48852 -5.80397 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 0.0 0.0 0.0 1.4593650175517759e-22 1.31396909019291e-19 3.0684886894367996e-19 4.2193642091716797e-19 4.84035185074374e-19 5.12345646197154e-19 5.33375816695038e-19 5.52095648486694e-19 5.687006071214699e-19 5.83350910262766e-19 5.961891516310079e-19 6.073322901204779e-19 6.168876715656539e-19 6.249450178580399e-19 6.31589244359238e-19 6.368924490177779e-19 6.40921923252288e-19 6.437353454215919e-19 6.45387189531246e-19 6.45927123056904e-19 6.45664366088928e-19 6.44797588529934e-19 6.431857988361299e-19 6.40647951047874e-19 6.36954933906504e-19 6.31803936028194e-19 6.247928110778099e-19 6.15384829882962e-19 6.02838184662108e-19 5.8610825624988e-19 5.63692202963586e-19 5.33342170985724e-19 4.9156861960744195e-19 4.3268382177804e-19 3.0466510219153795e-19 2.35725043807152e-20 -3.9870485972416793e-19 -9.29898511843698e-19 ] } }