{ "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" [ 5.68722 5.306155 5.069987 4.898397 4.763549 4.652449 4.557973 4.475786 4.403057 4.337831 4.278705 4.224634 4.174822 4.128646 4.085612 4.045318 4.007438 3.971698 3.937868 3.905756 3.875195 3.846042 3.818173 3.79148 3.773308 3.754182 3.733998 3.712631 3.689933 3.665729 3.639802 3.611891 3.581665 3.548705 3.512467 3.472227 3.426989 3.375334 3.315135 3.242995 3.152974 3.03318 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.68722e-10 5.306155000000001e-10 5.069987e-10 4.898397e-10 4.763549e-10 4.652449e-10 4.557973e-10 4.4757860000000004e-10 4.403057000000001e-10 4.337831000000001e-10 4.2787050000000005e-10 4.224634e-10 4.174822e-10 4.128646e-10 4.0856120000000006e-10 4.045318e-10 4.007438e-10 3.971698e-10 3.937868e-10 3.905756e-10 3.875195e-10 3.8460420000000004e-10 3.818173e-10 3.79148e-10 3.7733080000000003e-10 3.7541820000000003e-10 3.733998e-10 3.712631e-10 3.689933e-10 3.665729e-10 3.6398020000000003e-10 3.611891e-10 3.5816650000000004e-10 3.548705e-10 3.5124670000000004e-10 3.4722270000000005e-10 3.426989e-10 3.375334e-10 3.315135e-10 3.242995e-10 3.152974e-10 3.0331800000000003e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0 0.824253 1.06963 1.28226 1.52809 1.83675 2.00316 2.15033 2.28213 2.40017 2.50575 2.59995 2.68366 2.75766 2.82259 2.87904 2.9275 2.96841 3.00218 3.02916 3.04968 3.06401 3.07244 3.0752 3.07385 3.06943 3.06119 3.04822 3.02932 3.00296 2.96707 2.91887 2.85456 2.76877 2.65375 2.49792 2.28333 1.98064 1.53892 0.861874 -0.25526 -2.33312 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 0.0 1.3205988862242624e-19 1.7137361789063042e-19 2.054406993787008e-19 2.448270072478272e-19 2.9427979082544004e-19 3.209416119721728e-19 3.445208453004864e-19 3.656375331626304e-19 3.8454962599455364e-19 4.0146540675696e-19 4.1655791052489604e-19 4.2996973101761284e-19 4.418258380115328e-19 4.522287708103872e-19 4.612730578348032e-19 4.690372057392e-19 4.755917102948929e-19 4.8100226074333445e-19 4.853249332662528e-19 4.886125996921345e-19 4.909085187897409e-19 4.922591536810752e-19 4.927013544284161e-19 4.92485060584608e-19 4.917768985182144e-19 4.904567049826752e-19 4.883786819054977e-19 4.853505680921856e-19 4.811272305197568e-19 4.753770186277056e-19 4.676545273154497e-19 4.573509294670848e-19 4.436058562372416e-19 4.251776207448e-19 4.0021090246287367e-19 3.658297943571264e-19 3.173335102221312e-19 2.4656216452815365e-19 1.3808743728753794e-19 -4.08971604225408e-20 -3.738070317520896e-19 ] } }