{ "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" [ "Ni" "Ni" ] } "a" { "source-value" [ 4.15312 3.874846 3.702383 3.57708 3.478606 3.397476 3.328484 3.268467 3.215356 3.167725 3.124547 3.085062 3.048686 3.014966 2.983541 2.954116 2.926454 2.900354 2.87565 2.8522 2.829883 2.808594 2.788243 2.76875 2.75548 2.741513 2.726774 2.71117 2.694595 2.67692 2.657987 2.637605 2.615532 2.591463 2.565 2.535615 2.50258 2.464859 2.420899 2.368218 2.30248 2.215 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.1531200000000005e-10 3.874846e-10 3.7023830000000003e-10 3.5770800000000003e-10 3.478606e-10 3.3974760000000005e-10 3.328484e-10 3.268467e-10 3.215356e-10 3.167725e-10 3.1245470000000004e-10 3.0850620000000003e-10 3.048686e-10 3.014966e-10 2.983541e-10 2.954116e-10 2.926454e-10 2.900354e-10 2.87565e-10 2.8521999999999997e-10 2.8298830000000005e-10 2.808594e-10 2.788243e-10 2.76875e-10 2.75548e-10 2.741513e-10 2.726774e-10 2.71117e-10 2.694595e-10 2.67692e-10 2.657987e-10 2.6376050000000003e-10 2.6155320000000003e-10 2.5914630000000004e-10 2.565e-10 2.535615e-10 2.50258e-10 2.4648590000000003e-10 2.420899e-10 2.368218e-10 2.3024800000000001e-10 2.2149999999999998e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.36997 1.96012 2.36609 2.66316 2.89852 3.09966 3.27962 3.44361 3.59211 3.72432 3.83994 3.93934 4.02363 4.09452 4.15377 4.20301 4.24362 4.27682 4.30358 4.32463 4.3405 4.35155 4.35804 4.36017 4.35913 4.35568 4.34922 4.33899 4.32397 4.30283 4.27375 4.23428 4.18097 4.10893 4.01098 3.8761 3.68661 3.41308 3.00384 2.36182 1.28658 -0.693528 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.194933905197376e-19 3.1404584379624965e-19 3.790894080708672e-19 4.2668526894497284e-19 4.643940978921217e-19 4.966202784428929e-19 5.254530489108096e-19 5.517271433153088e-19 5.755194661341888e-19 5.967018432377856e-19 6.1522620932747525e-19 6.3115184493822725e-19 6.446565916749504e-19 6.560144217398016e-19 6.6550731821804155e-19 6.733964358988608e-19 6.799028751559296e-19 6.852221015369856e-19 6.895095261742465e-19 6.928821079610304e-19 6.9542476225824e-19 6.97195167424224e-19 6.982349800511232e-19 6.985762436713537e-19 6.984096173027905e-19 6.978568663686145e-19 6.968218602715776e-19 6.9518283358849925e-19 6.927763643040577e-19 6.893893629276864e-19 6.847302333144e-19 6.784064421921024e-19 6.6986523862661765e-19 6.583231582503745e-19 6.426298382496384e-19 6.2101967998828805e-19 5.906600352007489e-19 5.468356980920064e-19 4.812682220623872e-19 3.784052786537856e-19 2.0613283967888642e-19 -1.1111543474701825e-19 ] } }