{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "sc" ] } "species" { "source-value" [ "Si" ] } "a" { "source-value" [ 3.81657 3.560846 3.402358 3.287208 3.196714 3.122158 3.058757 3.003603 2.954796 2.911024 2.871346 2.83506 2.801632 2.770645 2.741765 2.714725 2.689305 2.66532 2.642618 2.621068 2.600559 2.580995 2.562293 2.54438 2.526271 2.507609 2.48836 2.468485 2.447944 2.426688 2.404667 2.381824 2.358095 2.333409 2.307684 2.28083 2.252742 2.223303 2.192376 2.159801 2.125394 2.088936 2.050167 2.008773 1.964375 1.916501 1.86456 1.807797 1.745223 1.675513 1.596825 1.506502 1.400496 1.27219 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.8165700000000003e-10 3.5608460000000004e-10 3.402358e-10 3.287208e-10 3.196714e-10 3.1221580000000004e-10 3.058757e-10 3.0036030000000003e-10 2.954796e-10 2.911024e-10 2.871346e-10 2.83506e-10 2.8016320000000003e-10 2.770645e-10 2.741765e-10 2.714725e-10 2.689305e-10 2.6653200000000003e-10 2.6426180000000003e-10 2.6210680000000005e-10 2.600559e-10 2.580995e-10 2.562293e-10 2.54438e-10 2.526271e-10 2.507609e-10 2.48836e-10 2.4684849999999997e-10 2.447944e-10 2.426688e-10 2.404667e-10 2.381824e-10 2.3580950000000003e-10 2.333409e-10 2.3076840000000003e-10 2.28083e-10 2.252742e-10 2.2233030000000001e-10 2.192376e-10 2.159801e-10 2.125394e-10 2.088936e-10 2.0501670000000001e-10 2.0087730000000003e-10 1.964375e-10 1.916501e-10 1.86456e-10 1.8077970000000003e-10 1.745223e-10 1.675513e-10 1.596825e-10 1.506502e-10 1.400496e-10 1.27219e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0 0 0 0 0 0 0 0.256816 0.925259 1.73112 2.49238 3.12109 3.59031 3.90484 4.08232 4.15189 4.1965 4.23306 4.26208 4.284 4.29922 4.30812 4.31102 4.3079 4.29783 4.27957 4.25164 4.2123 4.15944 4.09054 4.00254 3.89172 3.75354 3.58238 3.37129 3.11158 2.79228 2.39941 1.915 1.31564 -0.25862 -3.59732 -7.74954 -12.3117 -16.8269 -21.2785 -27.147 -35.1221 -48.6946 -72.2598 -101.579 -155.483 -267.212 ] "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 0.0 4.1146459443734393e-20 1.482428350198206e-19 2.77356001465008e-19 3.9932329990489194e-19 5.00053747061106e-19 5.75231079081654e-19 6.25624340750856e-19 6.54059771651088e-19 6.65206114493826e-19 6.723534244581e-19 6.78210982232004e-19 6.82860498823872e-19 6.863724700055999e-19 6.88810982842548e-19 6.902369200468079e-19 6.90701551270668e-19 6.902016721608599e-19 6.88588280290422e-19 6.856627057567379e-19 6.81187826417976e-19 6.7488486353982e-19 6.664157578524959e-19 6.55376760844236e-19 6.412776064650359e-19 6.235222850070479e-19 6.01383408278436e-19 5.73960553010892e-19 5.401402064437859e-19 4.98530077082172e-19 4.473725771585519e-19 3.8442786373859397e-19 3.06816825411e-19 2.1078876667557597e-19 -4.1435492108508e-20 -5.763542049020879e-19 -1.2416131912248358e-18 -1.9725518064817797e-18 -2.6959666002654597e-18 -3.4091915506569e-18 -4.3494289083197995e-18 -5.62718079570114e-18 -7.80173503219764e-18 -1.157729631375132e-17 -1.6274750030508597e-17 -2.4911122958422198e-17 -4.2812082272440796e-17 ] } }