{ "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" [ "Pb" "Pb" ] } "a" { "source-value" [ 5.92511 5.528105 5.282057 5.10329 4.962801 4.847054 4.748625 4.663001 4.587229 4.519275 4.457676 4.401343 4.349447 4.30134 4.256505 4.214527 4.175062 4.137826 4.102582 4.069126 4.037287 4.006914 3.97788 3.95007 3.931138 3.911213 3.890184 3.867924 3.844277 3.81906 3.79205 3.762971 3.731481 3.697143 3.65939 3.617467 3.570337 3.516522 3.453806 3.378649 3.284863 3.16006 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.925110000000001e-10 5.528105e-10 5.282057000000001e-10 5.10329e-10 4.962801e-10 4.847054000000001e-10 4.748625e-10 4.663001000000001e-10 4.587229e-10 4.5192750000000004e-10 4.457676e-10 4.401343e-10 4.349447e-10 4.30134e-10 4.256505e-10 4.2145270000000006e-10 4.1750619999999997e-10 4.137826e-10 4.1025820000000003e-10 4.069126e-10 4.037287e-10 4.006914e-10 3.97788e-10 3.9500700000000004e-10 3.9311379999999997e-10 3.9112130000000004e-10 3.890184e-10 3.867924e-10 3.8442770000000003e-10 3.81906e-10 3.7920500000000004e-10 3.762971e-10 3.731481e-10 3.6971430000000004e-10 3.65939e-10 3.617467e-10 3.570337e-10 3.5165220000000005e-10 3.4538060000000004e-10 3.3786489999999997e-10 3.2848630000000003e-10 3.1600600000000005e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.877111 1.06783 1.17074 1.24682 1.31196 1.37309 1.43359 1.49381 1.55234 1.61031 1.66635 1.71972 1.76995 1.81642 1.8526 1.88727 1.91591 1.93708 1.9565 1.97222 1.98428 1.99275 1.99775 1.9994 1.9986 1.99594 1.99099 1.98312 1.97153 1.95389 1.92579 1.89098 1.84534 1.78481 1.70385 1.59402 1.43141 1.20208 0.860914 0.32283 -0.605281 -2.44275 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.4052867496243738e-19 1.71085227508422e-19 1.8757322724891598e-19 1.99762587080388e-19 2.1019916567426398e-19 2.1999327143790596e-19 2.2968644007360598e-19 2.39334747763554e-19 2.48712287602356e-19 2.5800010554965397e-19 2.6697870340659e-19 2.7552952010224797e-19 2.8357725333482995e-19 2.91022568153028e-19 2.9681924321483996e-19 3.02373989604918e-19 3.06962623484694e-19 3.1035443141887196e-19 3.1346585844209994e-19 3.15984480110748e-19 3.17916705131352e-19 3.1927374874034996e-19 3.2007483705734995e-19 3.2033919620196e-19 3.2021102207124e-19 3.19784843086596e-19 3.18991765652766e-19 3.1773085264180797e-19 3.15873929923002e-19 3.1304769034062597e-19 3.0854557399908597e-19 3.02968397136132e-19 2.9565606297855596e-19 2.8595808781295396e-19 2.7298686578408997e-19 2.55390159812868e-19 2.29337165567394e-19 1.92594448819872e-19 1.379336294683476e-19 5.1723068275421995e-20 -9.697670752041539e-20 -3.9137169727035e-19 ] } }