{ "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" [ 6.06697 5.660461 5.408523 5.225477 5.081625 4.963107 4.862322 4.774648 4.697062 4.627481 4.564407 4.506726 4.453588 4.404329 4.358421 4.315437 4.275028 4.236901 4.200813 4.166556 4.133955 4.102855 4.073125 4.04465 4.025265 4.004862 3.98333 3.960536 3.936323 3.910503 3.882845 3.85307 3.820826 3.785665 3.747008 3.704081 3.655823 3.600719 3.536501 3.459544 3.363512 3.23572 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.066970000000001e-10 5.660461e-10 5.408523e-10 5.225477e-10 5.081625e-10 4.963107e-10 4.862322e-10 4.774648e-10 4.697062e-10 4.6274810000000005e-10 4.5644070000000004e-10 4.5067259999999996e-10 4.453588e-10 4.404329e-10 4.358421e-10 4.3154370000000003e-10 4.275028e-10 4.236901e-10 4.200813e-10 4.1665560000000003e-10 4.1339550000000005e-10 4.102855e-10 4.0731250000000003e-10 4.04465e-10 4.0252650000000003e-10 4.004862e-10 3.9833300000000003e-10 3.960536e-10 3.9363229999999997e-10 3.910503e-10 3.882845e-10 3.85307e-10 3.820826e-10 3.785665e-10 3.747008e-10 3.7040810000000003e-10 3.655823e-10 3.600719e-10 3.536501e-10 3.4595440000000004e-10 3.363512e-10 3.23572e-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" [ 1.28749 1.65555 1.92415 2.13798 2.31548 2.46393 2.5927 2.7057 2.80467 2.89164 2.96815 3.03542 3.09443 3.14599 3.19075 3.22929 3.26209 3.28955 3.31205 3.3299 3.34338 3.35274 3.35822 3.36 3.35914 3.3563 3.35104 3.3428 3.33084 3.31423 3.29171 3.26163 3.22169 3.16871 3.0981 3.00306 2.87309 2.69123 2.42816 2.02904 1.37841 0.186383 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.06278639450866e-19 2.6524835264187e-19 3.0828281703111e-19 3.42542159995932e-19 3.7098079524943198e-19 3.94765107381162e-19 4.1539633589717995e-19 4.3350093186138e-19 4.49357674008078e-19 4.63291804193976e-19 4.755500576207099e-19 4.86327899837628e-19 4.95782344154862e-19 5.040431668797659e-19 5.1121450949355e-19 5.17389298240986e-19 5.22644437600506e-19 5.2704401463747e-19 5.3064891206397e-19 5.335087973556599e-19 5.356685314582919e-19 5.371681687877159e-19 5.38046161583148e-19 5.38331349024e-19 5.38193561833476e-19 5.3773854366942e-19 5.36895798759936e-19 5.3557560521352e-19 5.3365940195925595e-19 5.309981865701819e-19 5.27390084790414e-19 5.225707374753419e-19 5.16171643999146e-19 5.076833121922139e-19 4.9637034297954e-19 4.811432562500039e-19 4.60319766537906e-19 4.3118258227198195e-19 3.89034121561344e-19 3.25088047745136e-19 2.2084562940719397e-19 2.98618487574822e-20 ] } }