{ "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" [ 1.39252 1.98267 2.38863 2.6857 2.92107 3.12221 3.30216 3.46616 3.61466 3.74687 3.86249 3.96189 4.04618 4.11706 4.17632 4.22555 4.26617 4.29937 4.32613 4.34718 4.36305 4.37409 4.38058 4.38271 4.38167 4.37822 4.37177 4.36153 4.34652 4.32537 4.2963 4.25682 4.20351 4.13148 4.03353 3.89865 3.70916 3.43562 3.02638 2.38436 1.30913 -0.670981 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.231062987996416e-19 3.176587520761536e-19 3.8270071417415043e-19 4.3029657504825603e-19 4.680070061720256e-19 5.002331867227969e-19 5.290643550140928e-19 5.553400515952128e-19 5.791323744140929e-19 6.003147515176896e-19 6.188391176073792e-19 6.3476475321813125e-19 6.482694999548544e-19 6.596257278430849e-19 6.6912022649794555e-19 6.77007742002144e-19 6.835157834358336e-19 6.888350098168896e-19 6.931224344541505e-19 6.964950162409344e-19 6.990376705381441e-19 7.008064735275072e-19 7.018462861544065e-19 7.021875497746369e-19 7.020209234060736e-19 7.014681724718976e-19 7.004347685514816e-19 6.987941396917824e-19 6.963892725839616e-19 6.930006690309697e-19 6.88343141594304e-19 6.820177482953857e-19 6.734765447299008e-19 6.619360665302784e-19 6.462427465295424e-19 6.2463258826819205e-19 5.942729434806528e-19 5.504470041952896e-19 4.848795281656704e-19 3.8201658475706884e-19 2.097457479587904e-19 -1.0750300712010049e-19 ] } }