{ "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" [ "Al" "Al" ] } "a" { "source-value" [ 4.80759 4.485464 4.285823 4.140773 4.026781 3.932865 3.853001 3.783526 3.722045 3.666908 3.616927 3.571219 3.529111 3.490077 3.453699 3.419638 3.387616 3.357404 3.328807 3.301661 3.275827 3.251183 3.227625 3.20506 3.189699 3.173531 3.156469 3.138407 3.11922 3.098759 3.076843 3.053249 3.027698 2.999836 2.969203 2.935187 2.896947 2.853282 2.802394 2.741412 2.665315 2.56405 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.80759e-10 4.4854640000000006e-10 4.285823e-10 4.1407730000000005e-10 4.0267809999999996e-10 3.932865e-10 3.853001e-10 3.7835260000000004e-10 3.722045e-10 3.666908e-10 3.616927e-10 3.5712190000000004e-10 3.529111e-10 3.490077e-10 3.453699e-10 3.419638e-10 3.387616e-10 3.357404e-10 3.328807e-10 3.301661e-10 3.275827e-10 3.2511830000000004e-10 3.2276250000000005e-10 3.2050600000000003e-10 3.189699e-10 3.173531e-10 3.156469e-10 3.138407e-10 3.11922e-10 3.098759e-10 3.0768430000000004e-10 3.053249e-10 3.027698e-10 2.9998360000000004e-10 2.969203e-10 2.935187e-10 2.896947e-10 2.8532820000000003e-10 2.802394e-10 2.741412e-10 2.665315e-10 2.56405e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.00859 1.39491 1.68267 1.91283 2.10364 2.26522 2.40389 2.52395 2.62847 2.71976 2.79958 2.86933 2.93016 2.98298 3.02859 3.06763 3.10066 3.12818 3.15061 3.16831 3.18162 3.19082 3.19617 3.1979 3.19707 3.19433 3.18927 3.18136 3.16994 3.15414 3.13283 3.10449 3.06709 3.01777 2.9525 2.86532 2.74716 2.58347 2.34953 1.99974 1.43991 0.439138 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.61593933128606e-19 2.23489220853294e-19 2.69593455673278e-19 3.0646915308142197e-19 3.37040285434776e-19 3.629282554869479e-19 3.85145638870626e-19 4.0438137153843e-19 4.2112732171699797e-19 4.35753592208784e-19 4.48542166101372e-19 4.59717348123522e-19 4.69463388588144e-19 4.779260855689319e-19 4.85233613196606e-19 4.914885107757419e-19 4.96780500197844e-19 5.01189690294612e-19 5.04783372484674e-19 5.07619225126854e-19 5.09751722226708e-19 5.11225724729988e-19 5.12082889229178e-19 5.1236006578686e-19 5.122270851262379e-19 5.117880887285219e-19 5.10977387351718e-19 5.09710065634224e-19 5.078803799181959e-19 5.053489408364759e-19 5.019347024294219e-19 4.97394133848666e-19 4.914019932375059e-19 4.83500058078618e-19 4.730426511884999e-19 4.59074875293288e-19 4.40143556185944e-19 4.13917526863998e-19 3.76436206688202e-19 3.2039367020751597e-19 2.30699015706294e-19 7.03576642701492e-20 ] } }