{ "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" [ "Li" "Li" ] } "a" { "source-value" [ 5.25929 4.906897 4.688499 4.52982 4.405118 4.302378 4.21501 4.139007 4.07175 4.011432 3.956755 3.906752 3.860688 3.817987 3.77819 3.740929 3.705899 3.672848 3.641564 3.611868 3.583606 3.556647 3.530875 3.50619 3.489385 3.471699 3.453034 3.433274 3.412284 3.389901 3.365926 3.340115 3.312163 3.281683 3.248172 3.21096 3.169126 3.121358 3.065689 2.998977 2.91573 2.80495 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.259290000000001e-10 4.906897e-10 4.688499000000001e-10 4.52982e-10 4.405118e-10 4.3023780000000003e-10 4.2150100000000005e-10 4.1390070000000006e-10 4.07175e-10 4.011432e-10 3.956755e-10 3.906752e-10 3.860688e-10 3.817987e-10 3.77819e-10 3.740929e-10 3.7058990000000003e-10 3.6728480000000003e-10 3.641564e-10 3.611868e-10 3.5836060000000003e-10 3.556647e-10 3.530875e-10 3.50619e-10 3.489385e-10 3.471699e-10 3.4530340000000004e-10 3.433274e-10 3.4122840000000003e-10 3.389901e-10 3.365926e-10 3.3401150000000003e-10 3.3121630000000003e-10 3.2816830000000004e-10 3.248172e-10 3.21096e-10 3.169126e-10 3.1213579999999997e-10 3.065689e-10 2.998977e-10 2.91573e-10 2.8049499999999997e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.0655595 0.147218 0.205944 0.249509 0.284573 0.314811 0.342586 0.369109 0.3947 0.419171 0.442146 0.463254 0.482217 0.498878 0.513196 0.52522 0.535073 0.542923 0.548968 0.553416 0.55652 0.558525 0.559593 0.559909 0.559776 0.559374 0.558696 0.557728 0.556436 0.554749 0.552525 0.549505 0.545238 0.53898 0.529526 0.514948 0.492131 0.455903 0.397282 0.29514 0.105031 -0.291181 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.0503789817133762e-20 2.358692377609344e-20 3.299586619940352e-20 3.9975748647918725e-20 4.559362075109185e-20 5.0438282417066884e-20 5.488832798133889e-20 5.913778103268673e-20 6.3237911222976e-20 6.715859763173569e-20 7.083959841802369e-20 7.422147282920832e-20 7.725968035523136e-20 7.992906682314624e-20 8.222306330880768e-20 8.414952047765761e-20 8.572814510213185e-20 8.698585374945986e-20 8.795436951673345e-20 8.866701767766529e-20 8.916433330076161e-20 8.948556971323201e-20 8.965668217633345e-20 8.970731095755073e-20 8.968600200849409e-20 8.962159450833793e-20 8.951296693344768e-20 8.935787623655425e-20 8.91508750171469e-20 8.888058782121794e-20 8.852426374075202e-20 8.804040640127041e-20 8.735675763717505e-20 8.63541155078784e-20 8.483941773057409e-20 8.250376465277184e-20 7.884807825709249e-20 7.304371279525824e-20 6.365159322646657e-20 4.728664078629121e-20 1.682782126592448e-20 -4.665233906211649e-20 ] } }