{ "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" [ "Zn" "Zn" "Zn" "Zn" ] } "a" { "source-value" [ 5.83528 5.444295 5.201979 5.025923 4.887564 4.773572 4.676636 4.59231 4.517687 4.450764 4.390098 4.33462 4.283511 4.236133 4.191978 4.150636 4.11177 4.075099 4.040389 4.007441 3.976084 3.946172 3.917578 3.89019 3.871545 3.851922 3.831212 3.809288 3.786 3.761165 3.734564 3.705926 3.674913 3.641095 3.603914 3.562626 3.516211 3.463211 3.401445 3.327427 3.235062 3.11215 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.83528e-10 5.444295000000001e-10 5.201979e-10 5.025923e-10 4.887564000000001e-10 4.773572e-10 4.676636e-10 4.5923100000000003e-10 4.517687e-10 4.4507640000000007e-10 4.390098e-10 4.3346200000000004e-10 4.283511e-10 4.2361329999999996e-10 4.191978e-10 4.1506360000000007e-10 4.11177e-10 4.075099e-10 4.0403890000000004e-10 4.007441e-10 3.9760840000000004e-10 3.946172e-10 3.9175779999999997e-10 3.89019e-10 3.871545e-10 3.851922e-10 3.831212e-10 3.8092880000000003e-10 3.786e-10 3.761165e-10 3.734564e-10 3.705926e-10 3.6749130000000004e-10 3.641095e-10 3.603914e-10 3.562626e-10 3.516211e-10 3.463211e-10 3.401445e-10 3.327427e-10 3.2350620000000003e-10 3.1121500000000005e-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" [ 0.320735 0.466345 0.580638 0.676639 0.760145 0.834293 0.90098 0.961435 1.01649 1.06674 1.11261 1.15441 1.19237 1.22667 1.25745 1.28481 1.30882 1.32954 1.34703 1.3613 1.37238 1.38029 1.38503 1.38661 1.38583 1.3832 1.37823 1.37027 1.35848 1.34169 1.31835 1.28626 1.24233 1.18201 1.09852 0.981237 0.812876 0.563655 0.178491 -0.454772 -1.60267 -4.07682 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 5.1387412270598996e-20 7.4716706238273e-20 9.30284636412492e-20 1.0840951954531259e-19 1.2178865574519299e-19 1.3366847505097618e-19 1.44352910370132e-19 1.5403886921097899e-19 1.6285965266946598e-19 1.70910590255316e-19 1.78259774475474e-19 1.8495687280559397e-19 1.9103873530825798e-19 1.9653420116287797e-19 2.0146570084233e-19 2.0584925611295398e-19 2.09696082211188e-19 2.1301579219683598e-19 2.1581799912970198e-19 2.1810430518641998e-19 2.1987951689689197e-19 2.21146838614386e-19 2.21906270338902e-19 2.2215941424707395e-19 2.2203444446962196e-19 2.2161307201487996e-19 2.20816790227782e-19 2.19541457627118e-19 2.1765249137563196e-19 2.1496243680714598e-19 2.1122295654338996e-19 2.0608157172488399e-19 1.9904320977172198e-19 1.8937888031543399e-19 1.7600230759816798e-19 1.572114993816258e-19 1.302370933539384e-19 9.030748706372699e-20 2.85974109579294e-20 -7.28625072197448e-20 -2.56776042601278e-19 -6.531785745023879e-19 ] } }