{ "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" [ "Mo" ] } "a" { "source-value" [ 3.79941 3.544835 3.38706 3.272428 3.182341 3.10812 3.045004 2.990098 2.941511 2.897936 2.858436 2.822313 2.789036 2.758187 2.729438 2.70252 2.677213 2.653336 2.630736 2.609283 2.588867 2.569391 2.550773 2.53294 2.5208 2.508023 2.494539 2.480264 2.465101 2.448931 2.43161 2.412964 2.392771 2.370752 2.346543 2.31966 2.289438 2.25493 2.214713 2.166519 2.10638 2.02635 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 3.79941e-10 3.5448350000000003e-10 3.3870600000000003e-10 3.272428e-10 3.182341e-10 3.10812e-10 3.045004e-10 2.990098e-10 2.9415110000000005e-10 2.897936e-10 2.8584360000000003e-10 2.822313e-10 2.789036e-10 2.758187e-10 2.729438e-10 2.70252e-10 2.6772130000000003e-10 2.653336e-10 2.630736e-10 2.609283e-10 2.588867e-10 2.569391e-10 2.5507730000000003e-10 2.53294e-10 2.5208e-10 2.508023e-10 2.494539e-10 2.480264e-10 2.4651010000000004e-10 2.448931e-10 2.43161e-10 2.412964e-10 2.3927710000000003e-10 2.370752e-10 2.3465430000000004e-10 2.31966e-10 2.289438e-10 2.25493e-10 2.214713e-10 2.166519e-10 2.1063800000000002e-10 2.02635e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] ] } "cohesive-potential-energy" { "source-value" [ 1.30829 2.14979 2.63738 2.9475 3.17827 3.39276 3.61521 3.85047 4.09144 4.32812 4.55227 4.75876 4.94515 5.11094 5.25674 5.38374 5.49328 5.5867 5.66477 5.72782 5.77622 5.81035 5.83057 5.83724 5.83397 5.82313 5.80284 5.77074 5.72372 5.65776 5.56749 5.44574 5.28265 5.06454 4.77192 4.37626 3.83373 3.06378 1.93662 0.220351 -2.55981 -7.63528 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.096111651226432e-19 3.444343277629632e-19 4.225548576165504e-19 4.722415589808e-19 5.092149888590016e-19 5.435800751985408e-19 5.792204941282368e-19 6.169133013091776e-19 6.555209513405953e-19 6.934412676016897e-19 7.293540565569217e-19 7.624374015998207e-19 7.92300371634912e-19 8.188628578311553e-19 8.422225929624192e-19 8.625702360465793e-19 8.801204787508225e-19 8.950880127423362e-19 9.075962056209217e-19 9.176979292150657e-19 9.254524640597378e-19 9.30920692866528e-19 9.341602939937856e-19 9.352289457998593e-19 9.347050340448576e-19 9.329682745879105e-19 9.297174582243072e-19 9.245744712715392e-19 9.170410368005377e-19 9.064730798097408e-19 8.920102314537793e-19 8.725037310955392e-19 8.463738325869121e-19 8.114287583106433e-19 7.645458660327936e-19 7.011541458542209e-19 6.142312576459585e-19 4.908716687274624e-19 3.102807287373696e-19 3.530412205699008e-20 -4.1012677356900486e-19 -1.2233067109261825e-18 ] } }