{ "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" [ 4.17946 3.899421 3.725865 3.599766 3.500669 3.419023 3.349594 3.289196 3.235748 3.187815 3.144364 3.104628 3.068022 3.034088 3.002463 2.972852 2.945014 2.918749 2.893888 2.87029 2.847831 2.826407 2.805926 2.78631 2.772956 2.758901 2.744068 2.728365 2.711685 2.693898 2.674845 2.654333 2.632121 2.607899 2.581269 2.551697 2.518453 2.480493 2.436254 2.383239 2.317084 2.22905 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.17946e-10 3.899421e-10 3.725865e-10 3.599766e-10 3.500669e-10 3.4190230000000004e-10 3.349594e-10 3.289196e-10 3.2357480000000003e-10 3.187815e-10 3.144364e-10 3.104628e-10 3.068022e-10 3.034088e-10 3.0024630000000003e-10 2.9728520000000004e-10 2.945014e-10 2.918749e-10 2.893888e-10 2.87029e-10 2.847831e-10 2.8264070000000004e-10 2.805926e-10 2.78631e-10 2.772956e-10 2.758901e-10 2.744068e-10 2.7283650000000003e-10 2.7116850000000004e-10 2.693898e-10 2.674845e-10 2.654333e-10 2.632121e-10 2.607899e-10 2.581269e-10 2.551697e-10 2.518453e-10 2.480493e-10 2.436254e-10 2.383239e-10 2.317084e-10 2.2290500000000002e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.461085 0.981578 1.58673 2.16098 2.59615 2.90448 3.13272 3.32639 3.50239 3.65861 3.79181 3.9034 3.99604 4.07237 4.13457 4.18462 4.22441 4.25594 4.28112 4.30142 4.31756 4.32918 4.3359 4.33801 4.33703 4.33385 4.32802 4.319 4.3059 4.28739 4.26147 4.22527 4.17441 4.10227 4.00002 3.85539 3.65263 3.38097 3.03038 2.56939 1.91841 1.08944 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 7.3873961328789e-20 1.5726613360484518e-19 2.54222173046682e-19 3.4622716625413194e-19 4.1594908683591e-19 4.653489989920319e-19 5.01917078486448e-19 5.32946433357126e-19 5.61144742115526e-19 5.86173945491874e-19 6.07514938256754e-19 6.253936273155599e-19 6.402361916529359e-19 6.52465605900258e-19 6.62431144563738e-19 6.704500386169079e-19 6.768250994435939e-19 6.818767623705959e-19 6.859110431350079e-19 6.89163461702028e-19 6.91749374789304e-19 6.93611104038012e-19 6.946877667360599e-19 6.950258260058339e-19 6.94868812695702e-19 6.9435932052609e-19 6.93425251548468e-19 6.919800882245999e-19 6.8988123683406e-19 6.86915607884526e-19 6.82762766049198e-19 6.76962886634118e-19 6.688142162735939e-19 6.572561140359179e-19 6.408738579532679e-19 6.17701577295726e-19 5.852158438647419e-19 5.4169111342549795e-19 4.85520402814092e-19 4.1166166216332593e-19 3.07363167643194e-19 1.7454753121449598e-19 ] } }