{ "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" [ "Ta" "Ta" ] } "a" { "source-value" [ 4.95381 4.621886 4.416173 4.266712 4.149253 4.052481 3.970188 3.898599 3.835249 3.778435 3.726934 3.679836 3.636447 3.596226 3.558741 3.523644 3.490649 3.459517 3.43005 3.402079 3.375459 3.350066 3.325791 3.30254 3.286711 3.270052 3.252471 3.233859 3.214089 3.193005 3.170423 3.146111 3.119782 3.091073 3.059508 3.024458 2.985054 2.94006 2.887625 2.824788 2.746375 2.64203 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.95381e-10 4.621886e-10 4.416173e-10 4.266712e-10 4.149253e-10 4.0524810000000004e-10 3.970188e-10 3.898599e-10 3.8352490000000005e-10 3.778435e-10 3.7269340000000003e-10 3.679836e-10 3.636447e-10 3.5962260000000005e-10 3.558741e-10 3.523644e-10 3.490649e-10 3.459517e-10 3.43005e-10 3.402079e-10 3.375459e-10 3.350066e-10 3.3257910000000003e-10 3.30254e-10 3.286711e-10 3.270052e-10 3.252471e-10 3.233859e-10 3.214089e-10 3.193005e-10 3.1704230000000003e-10 3.146111e-10 3.119782e-10 3.0910730000000005e-10 3.059508e-10 3.0244580000000003e-10 2.985054e-10 2.94006e-10 2.887625e-10 2.824788e-10 2.746375e-10 2.64203e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.100069 0.730822 1.86528 2.95001 3.81268 4.51418 5.11347 5.63545 6.08686 6.47065 6.79193 7.05819 7.2776 7.45778 7.60527 7.7254 7.82255 7.90034 7.96184 8.00974 8.04578 8.07074 8.08528 8.09 8.08773 8.08026 8.06645 8.04482 8.0135 7.97012 7.912 7.83525 7.73456 7.60251 7.42849 7.19676 6.88314 6.44865 5.82617 4.88842 3.35524 0.460648 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.603282122668352e-20 1.1709059223662977e-19 2.988508007245824e-19 4.726437053126208e-19 6.108586758591744e-19 7.232513658082944e-19 8.192682085162177e-19 9.02898623768736e-19 9.752224786082688e-19 1.0367124151379521e-18 1.0881871456110144e-18 1.1308467003164352e-18 1.166000057553408e-18 1.1948680759069825e-18 1.2184985788871616e-18 1.237745526632832e-18 1.253310672503904e-18 1.2657740044371073e-18 1.2756273906550272e-18 1.2833018166686593e-18 1.2890760612100225e-18 1.2930750940555394e-18 1.2954046588621823e-18 1.2961608862272e-18 1.2957971921342786e-18 1.294600366198541e-18 1.292387760285216e-18 1.2889222522544257e-18 1.28390423507808e-18 1.2769539928970496e-18 1.26764214237696e-18 1.2553454368123202e-18 1.239213120417485e-18 1.2180563781398209e-18 1.1901753005846594e-18 1.1530480617508609e-18 1.1028005985693312e-18 1.033187626572192e-18 9.334553362806336e-19 7.832112236651137e-19 5.375687085172992e-19 7.380394560182784e-20 ] } }