{ "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" [ "Pt" "Pt" "Pt" "Pt" ] } "a" { "source-value" [ 5.88012 5.48613 5.241951 5.064542 4.92512 4.810252 4.712571 4.627596 4.5524 4.484962 4.423831 4.367926 4.316424 4.268682 4.224188 4.182528 4.143363 4.10641 4.071433 4.038232 4.006634 3.976493 3.947678 3.92008 3.901292 3.881517 3.860649 3.838557 3.815089 3.790063 3.763258 3.7344 3.703148 3.66907 3.631604 3.589999 3.543227 3.489819 3.427579 3.352992 3.259917 3.13606 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.88012e-10 5.486130000000001e-10 5.241951e-10 5.064542e-10 4.92512e-10 4.810252000000001e-10 4.712571e-10 4.627596e-10 4.5523999999999997e-10 4.4849620000000003e-10 4.423831e-10 4.367926e-10 4.3164239999999996e-10 4.2686820000000004e-10 4.224188e-10 4.182528e-10 4.143363e-10 4.1064100000000005e-10 4.071433e-10 4.038232e-10 4.0066340000000004e-10 3.976493e-10 3.947678e-10 3.92008e-10 3.9012920000000003e-10 3.881517e-10 3.860649e-10 3.8385570000000003e-10 3.815089e-10 3.7900630000000003e-10 3.7632580000000004e-10 3.7344e-10 3.703148e-10 3.66907e-10 3.631604e-10 3.589999e-10 3.543227e-10 3.489819e-10 3.427579e-10 3.352992e-10 3.2599170000000005e-10 3.1360600000000003e-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" [ 1.02617 1.71921 2.27769 2.76246 3.2035 3.59722 3.93433 4.21793 4.45707 4.66044 4.83478 4.98531 5.11608 5.23042 5.33105 5.42004 5.49882 5.56813 5.62809 5.67829 5.71812 5.74691 5.76423 5.77 5.76719 5.75797 5.74097 5.71459 5.67698 5.62485 5.55103 5.44952 5.31254 5.12928 4.88406 4.55315 4.09871 3.45685 2.51288 1.04505 -1.43091 -6.23745 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.6441055829663362e-19 2.754478068245568e-19 3.6492616674299526e-19 4.425948827895168e-19 5.132572804732801e-19 5.763381783874176e-19 6.303491544512064e-19 6.757868834170944e-19 7.141013351269056e-19 7.466848010641153e-19 7.746171482711425e-19 7.987347129440449e-19 8.196863766142465e-19 8.380056640964736e-19 8.541283674315841e-19 8.683861371800832e-19 8.810080845987457e-19 8.921127707575104e-19 9.017194217758272e-19 9.097623484122433e-19 9.161438178928896e-19 9.207564843841729e-19 9.235314542913985e-19 9.244559102016e-19 9.240056985711554e-19 9.225284917267778e-19 9.198047914714176e-19 9.155782495457473e-19 9.095524632749186e-19 9.01200316550688e-19 8.893730487359424e-19 8.731093538582015e-19 8.511627385064833e-19 8.2180124975370235e-19 7.825126746584448e-19 7.294950480995519e-19 6.566857337439168e-19 5.538484251612481e-19 4.0260775868759043e-19 1.67435467756704e-19 -2.292570548468928e-19 -9.99349656340896e-19 ] } }