{ "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" [ "Mn" "Mn" ] } "a" { "source-value" [ 4.18206 3.901847 3.728181 3.602004 3.502845 3.421148 3.351675 3.29124 3.237759 3.189796 3.146318 3.106557 3.069928 3.035973 3.004328 2.974698 2.946843 2.920562 2.895686 2.872072 2.849599 2.828162 2.807669 2.78804 2.774677 2.760614 2.745771 2.730059 2.713368 2.69557 2.676505 2.655981 2.633754 2.609517 2.58287 2.55328 2.520015 2.482031 2.437764 2.384716 2.31852 2.23043 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.18206e-10 3.9018470000000004e-10 3.7281810000000003e-10 3.6020040000000003e-10 3.5028450000000004e-10 3.421148e-10 3.351675e-10 3.2912400000000003e-10 3.2377590000000003e-10 3.189796e-10 3.146318e-10 3.106557e-10 3.069928e-10 3.035973e-10 3.0043280000000003e-10 2.974698e-10 2.946843e-10 2.920562e-10 2.8956860000000003e-10 2.872072e-10 2.849599e-10 2.828162e-10 2.8076690000000005e-10 2.78804e-10 2.774677e-10 2.760614e-10 2.745771e-10 2.730059e-10 2.7133680000000003e-10 2.69557e-10 2.676505e-10 2.655981e-10 2.633754e-10 2.609517e-10 2.58287e-10 2.55328e-10 2.520015e-10 2.4820310000000004e-10 2.437764e-10 2.384716e-10 2.31852e-10 2.23043e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.816381 0.800836 0.716126 0.600278 0.82819 1.95582 3.05327 4.05753 4.94591 5.71439 6.36878 6.91949 7.37857 7.75809 8.0693 8.32225 8.52566 8.687 8.81256 8.90753 8.97621 9.02212 9.04809 9.05635 9.05252 9.04002 9.01712 8.9816 8.93054 8.85995 8.76442 8.63631 8.46459 8.23298 7.91677 7.47706 6.85052 5.92917 4.51838 2.23987 -1.72349 -9.44715 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.3079865518653248e-19 1.283080716294989e-19 1.147360334747021e-19 9.617513775805825e-20 1.326906655580352e-19 3.133569078493056e-19 4.891877810990016e-19 6.500879704194624e-19 7.924221370580928e-19 9.155462060133313e-19 1.0203910419018624e-18 1.1086245105859392e-18 1.1821772348936256e-18 1.2429830420062274e-18 1.2928443806221441e-18 1.3333714382452801e-18 1.365961312888973e-18 1.39181083048896e-18 1.4119277601397249e-18 1.4271436315074625e-18 1.438147380539117e-18 1.4455029734052095e-18 1.4496638260894273e-18 1.450987223978208e-18 1.4503735903324417e-18 1.4483708695564417e-18 1.4447018850948097e-18 1.4390109537377281e-18 1.4308302399119233e-18 1.419520475145696e-18 1.4042148818871935e-18 1.3836893971981249e-18 1.3561768202657472e-18 1.3190688075513984e-18 1.2684063806250816e-18 1.197957072431885e-18 1.0975742984322818e-18 9.499577554748736e-19 7.239242799890304e-19 3.588667347631296e-19 -2.761335384182592e-19 -1.5136002863190722e-18 ] } }