{ "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" [ "Al" "Al" "Al" "Al" ] } "a" { "source-value" [ 6.075 5.667953 5.415681 5.232392 5.088349 4.969674 4.868755 4.780965 4.703277 4.633604 4.570446 4.512688 4.45948 4.410155 4.364187 4.321146 4.280683 4.242506 4.20637 4.172068 4.139423 4.108282 4.078513 4.05 4.030589 4.01016 3.988599 3.965775 3.94153 3.915675 3.887981 3.858167 3.82588 3.790673 3.751964 3.708981 3.660659 3.605482 3.541179 3.46412 3.367961 3.24 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.075e-10 5.667953e-10 5.415681e-10 5.232392e-10 5.088349e-10 4.969674000000001e-10 4.868755e-10 4.780965000000001e-10 4.703277000000001e-10 4.633604e-10 4.5704459999999997e-10 4.512688e-10 4.4594800000000003e-10 4.4101549999999995e-10 4.3641870000000003e-10 4.321146e-10 4.280683e-10 4.242506e-10 4.20637e-10 4.1720680000000007e-10 4.139423e-10 4.108282e-10 4.0785130000000005e-10 4.05e-10 4.030589e-10 4.01016e-10 3.988599e-10 3.965775e-10 3.9415300000000006e-10 3.915675e-10 3.887981e-10 3.858167e-10 3.8258800000000005e-10 3.7906730000000003e-10 3.751964e-10 3.7089810000000005e-10 3.660659e-10 3.605482e-10 3.541179e-10 3.46412e-10 3.367961e-10 3.24e-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" [ 0.467798 1.398 1.85195 2.06243 2.23513 2.38931 2.52724 2.64988 2.75733 2.85157 2.93558 3.01059 3.07648 3.133 3.18109 3.22201 3.2567 3.28568 3.30965 3.32872 3.34298 3.35269 3.35822 3.36 3.35919 3.35675 3.35264 3.34681 3.33909 3.32856 3.31353 3.29154 3.25912 3.2116 3.1433 3.04694 2.91287 2.72768 2.4725 2.11129 1.58 0.944421 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 7.49495025031932e-20 2.2398429343319997e-19 2.9671510173363e-19 3.30437715526062e-19 3.5810730599524195e-19 3.8280966533825396e-19 4.0490848765101597e-19 4.2455758189039196e-19 4.41772969822722e-19 4.56871882421538e-19 4.70331768323772e-19 4.82349695255406e-19 4.92906437096832e-19 5.019619394322e-19 5.09666806865106e-19 5.162229136514339e-19 5.2178086439478e-19 5.26423972280112e-19 5.3026438967180995e-19 5.33319740512848e-19 5.35604444392932e-19 5.37160157904546e-19 5.38046161583148e-19 5.38331349024e-19 5.38201572716646e-19 5.378106416179499e-19 5.37152147021376e-19 5.36218078043754e-19 5.34981197682306e-19 5.33294105686704e-19 5.3088603420580195e-19 5.273628477876359e-19 5.221685911402079e-19 5.1455504777543995e-19 5.0361218136522e-19 4.88173607319996e-19 4.66693225187958e-19 4.37022516102912e-19 3.961381727565e-19 3.3826595055978597e-19 2.53143908172e-19 1.5131292588589138e-19 ] } }