{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "diamond" ] } "species" { "source-value" [ "W" "W" "W" "W" "W" "W" "W" "W" ] } "a" { "source-value" [ 9.23754 8.618591 8.234991 7.956285 7.737256 7.5568 7.403345 7.269853 7.151721 7.045778 6.949741 6.861916 6.781008 6.706006 6.636107 6.57066 6.509132 6.451081 6.396133 6.343974 6.294335 6.246983 6.201717 6.15836 6.128844 6.097779 6.064995 6.030289 5.993423 5.954108 5.911998 5.866662 5.817567 5.764032 5.705173 5.639813 5.566335 5.482435 5.384657 5.267483 5.121266 4.92669 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 9.23754e-10 8.618591000000001e-10 8.234991000000001e-10 7.956285e-10 7.737256e-10 7.5568e-10 7.403345000000001e-10 7.269853e-10 7.151721000000001e-10 7.045778000000001e-10 6.949741000000001e-10 6.861916e-10 6.781008e-10 6.706006e-10 6.636107000000001e-10 6.570660000000001e-10 6.509132000000001e-10 6.451081000000001e-10 6.396133e-10 6.343974e-10 6.294335e-10 6.246983e-10 6.201717000000001e-10 6.15836e-10 6.128844e-10 6.097779e-10 6.064995e-10 6.030289e-10 5.993423e-10 5.954108e-10 5.911998e-10 5.866662e-10 5.817567e-10 5.764032000000001e-10 5.705173000000001e-10 5.639813000000001e-10 5.566334999999999e-10 5.482435e-10 5.384657e-10 5.267483e-10 5.121266e-10 4.92669e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0.5 0 ] [ 0.5 0 0.5 ] [ 0.75 0.25 0.75 ] [ 0.25 0.25 0.25 ] [ 0.25 0.75 0.75 ] [ 0.75 0.75 0.25 ] ] } "cohesive-potential-energy" { "source-value" [ 1.56985 2.33694 2.93481 3.41104 3.79576 4.0924 4.30614 4.46732 4.5892 4.68861 4.7869 4.89656 5.01466 5.13076 5.23736 5.33064 5.40847 5.46769 5.5141 5.55085 5.5794 5.60094 5.61632 5.62276 5.61883 5.60472 5.57647 5.53119 5.47016 5.39639 5.31473 5.22996 5.14221 5.05004 4.95046 4.83658 4.69947 4.52856 4.3038 3.96689 3.40245 2.3049 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.5151769888849e-19 3.7441906630599593e-19 4.70208400722954e-19 5.465088585639359e-19 6.081477980271839e-19 6.556747656981599e-19 6.89919689073276e-19 7.157435720600879e-19 7.352709008752799e-19 7.511981387938739e-19 7.6694593292945995e-19 7.84515401897904e-19 8.03437107945444e-19 8.22038378666184e-19 8.391175815846239e-19 8.540626852265759e-19 8.66532425968998e-19 8.76020515995546e-19 8.8345621775394e-19 8.8934421688389e-19 8.939184311739598e-19 8.973695196435958e-19 8.99833667306688e-19 9.00865469058984e-19 9.00235813641822e-19 8.97975142411248e-19 8.934489934201978e-19 8.86194337621446e-19 8.764162536241439e-19 8.645969965951259e-19 8.515136222018819e-19 8.37931970875464e-19 8.23872870912114e-19 8.091056088765359e-19 7.931511339551638e-19 7.749055464471719e-19 7.529381026183979e-19 7.255553017667039e-19 6.895447797409199e-19 6.35565846764826e-19 5.451325888353299e-19 3.6928569237065997e-19 ] } }