{ "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" [ "Sn" "Sn" ] } "a" { "source-value" [ 5.77572 5.388725 5.148882 4.974622 4.837676 4.724847 4.6289 4.545435 4.471574 4.405333 4.345287 4.290374 4.239787 4.192893 4.149189 4.108268 4.069799 4.033502 3.999146 3.966534 3.935498 3.905891 3.877588 3.85048 3.832025 3.812602 3.792104 3.770404 3.747353 3.722772 3.696442 3.668096 3.6374 3.603927 3.567125 3.526259 3.480317 3.427859 3.366723 3.29346 3.202038 3.08038 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.77572e-10 5.388725e-10 5.148882e-10 4.974622e-10 4.837676e-10 4.724847e-10 4.6289e-10 4.5454350000000004e-10 4.4715740000000003e-10 4.405333e-10 4.345287e-10 4.290374e-10 4.2397869999999997e-10 4.192893e-10 4.149189e-10 4.108268e-10 4.069799e-10 4.0335020000000007e-10 3.9991460000000004e-10 3.9665339999999997e-10 3.935498e-10 3.905891e-10 3.877588e-10 3.85048e-10 3.832025e-10 3.812602e-10 3.7921040000000005e-10 3.7704040000000005e-10 3.747353e-10 3.722772e-10 3.6964419999999997e-10 3.6680959999999997e-10 3.6374000000000003e-10 3.603927e-10 3.567125e-10 3.5262590000000004e-10 3.480317e-10 3.4278590000000005e-10 3.366723e-10 3.29346e-10 3.202038e-10 3.08038e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.577614 0.908514 1.18497 1.42388 1.6339 1.82034 1.98682 2.13596 2.26976 2.38978 2.49728 2.59333 2.67878 2.7544 2.82083 2.87863 2.92829 2.97026 3.00493 3.03265 3.05374 3.06849 3.07716 3.08 3.07862 3.07405 3.06555 3.05216 3.03265 3.00541 2.9683 2.91844 2.85187 2.76299 2.64373 2.48203 2.2591 1.94432 1.48433 0.778184 -0.389213 -2.56601 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 9.254396466467712e-20 1.4555998904694913e-19 1.8985312303493762e-19 2.281307246824704e-19 2.61779638072512e-19 2.916506189907072e-19 3.1832365537378563e-19 3.422185174963968e-19 3.6365564068270086e-19 3.8288496448554243e-19 4.001083631591424e-19 4.154972696019264e-19 4.2918786882666243e-19 4.41303528433152e-19 4.519467877251264e-19 4.612073685933504e-19 4.691637776922433e-19 4.758881129697408e-19 4.814428593140544e-19 4.85884092906912e-19 4.892630834001792e-19 4.916262939158593e-19 4.930153810460929e-19 4.934703992064e-19 4.932492988327296e-19 4.92517104117024e-19 4.911552539893441e-19 4.890099394940929e-19 4.85884092906912e-19 4.815197637918528e-19 4.7557408635206405e-19 4.675856337207552e-19 4.569199439560896e-19 4.426797981504192e-19 4.2357223977075843e-19 3.976650438124224e-19 3.6194772040492804e-19 3.115144047353856e-19 2.378158823552064e-19 1.2467882114806273e-19 -6.235879691114304e-20 -4.111201230739008e-19 ] } }