{ "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" [ 4.19852 3.917203 3.742854 3.61618 3.51663 3.434612 3.364865 3.304192 3.2505 3.202348 3.158699 3.118781 3.082008 3.047919 3.01615 2.986404 2.958439 2.932054 2.90708 2.883373 2.860812 2.83929 2.818716 2.79901 2.779088 2.758559 2.737383 2.71552 2.692922 2.669539 2.645315 2.620186 2.594082 2.566925 2.538625 2.509084 2.478185 2.4458 2.411777 2.375943 2.338092 2.297985 2.255336 2.2098 2.160959 2.108293 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.19852e-10 3.917203e-10 3.742854e-10 3.61618e-10 3.5166300000000003e-10 3.434612e-10 3.364865e-10 3.3041920000000004e-10 3.2505000000000003e-10 3.202348e-10 3.158699e-10 3.118781e-10 3.0820080000000003e-10 3.0479189999999997e-10 3.01615e-10 2.986404e-10 2.958439e-10 2.932054e-10 2.90708e-10 2.8833730000000003e-10 2.8608120000000003e-10 2.83929e-10 2.818716e-10 2.79901e-10 2.779088e-10 2.758559e-10 2.737383e-10 2.71552e-10 2.692922e-10 2.669539e-10 2.6453150000000003e-10 2.620186e-10 2.5940820000000003e-10 2.566925e-10 2.538625e-10 2.509084e-10 2.478185e-10 2.4458000000000005e-10 2.411777e-10 2.375943e-10 2.338092e-10 2.2979850000000004e-10 2.2553359999999998e-10 2.2098e-10 2.1609590000000002e-10 2.1082930000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.16602 1.72936 2.15039 2.4861 2.76558 3.00293 3.20884 3.3899 3.5482 3.68706 3.80903 3.91616 4.00679 4.08481 4.15195 4.20917 4.25729 4.29699 4.3289 4.35466 4.37493 4.38896 4.39712 4.39977 4.39694 4.38823 4.37251 4.34827 4.314 4.26675 4.20548 4.12761 4.03004 3.90904 3.75999 3.57727 3.35385 3.08098 2.74762 2.33569 1.82974 1.2054 0.430444 -0.538573 -1.75325 -3.29056 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.86816999877668e-19 2.77074018377424e-19 3.4453046119872594e-19 3.9831713297873997e-19 4.430947655457719e-19 4.81122427953762e-19 5.141128470244559e-19 5.431218571596599e-19 5.6848431327588e-19 5.907321380156039e-19 6.10273886420502e-19 6.27438004700544e-19 6.419585315344859e-19 6.544587136329539e-19 6.6521572755363e-19 6.74383382253378e-19 6.82093056216186e-19 6.88453697453166e-19 6.9356624309226e-19 6.97693450101444e-19 7.009410621385619e-19 7.03188915956064e-19 7.04496292089408e-19 7.04920868897418e-19 7.044674529099959e-19 7.030719570617819e-19 7.00553335393134e-19 6.96669659232318e-19 6.911789999075999e-19 6.836087153119499e-19 6.737921790754319e-19 6.613160296264739e-19 6.456835922085359e-19 6.262972549371359e-19 6.02416812207366e-19 5.731418407509179e-19 5.373460103940899e-19 4.93627416582132e-19 4.40217256311108e-19 3.74218794226746e-19 2.9315666742951597e-19 1.9312637146236e-19 6.896473190454959e-20 -8.62889076303282e-20 -2.8090161835604995e-19 -5.27205834477504e-19 ] } }