{ "short-name" { "source-value" [ "diamond" ] } "a" { "si-unit" "m" "source-unit" "angstrom" "si-value" [ 8.31237e-10 7.755410000000001e-10 7.410229000000001e-10 7.159437e-10 6.962344e-10 6.799962000000001e-10 6.661876e-10 6.541753000000001e-10 6.435453e-10 6.34012e-10 6.253701999999999e-10 6.174672000000001e-10 6.101867e-10 6.034378000000001e-10 5.971479000000001e-10 5.912587000000001e-10 5.857221000000001e-10 5.804984e-10 5.755538999999999e-10 5.708604000000001e-10 5.663937e-10 5.621327e-10 5.580593999999999e-10 5.54158e-10 5.51502e-10 5.487066e-10 5.457565e-10 5.426335e-10 5.393161000000001e-10 5.357784e-10 5.31989e-10 5.279095e-10 5.234917e-10 5.186743000000001e-10 5.133779e-10 5.074965e-10 5.008846e-10 4.933348e-10 4.845362e-10 4.739923e-10 4.6083489999999996e-10 4.43326e-10 ] "source-value" [ 8.31237 7.75541 7.410229 7.159437 6.962344 6.799962 6.661876 6.541753 6.435453 6.34012 6.253702 6.174672 6.101867 6.034378 5.971479 5.912587 5.857221 5.804984 5.755539 5.708604 5.663937 5.621327 5.580594 5.54158 5.51502 5.487066 5.457565 5.426335 5.393161 5.357784 5.31989 5.279095 5.234917 5.186743 5.133779 5.074965 5.008846 4.933348 4.845362 4.739923 4.608349 4.43326 ] } "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "cohesive-potential-energy" { "si-unit" "kg m^2 / s^2" "source-unit" "eV" "si-value" [ 3.166285525089792e-19 3.9030464441646723e-19 4.278788905274688e-19 4.5568626795807365e-19 4.785637479264768e-19 4.991052543817537e-19 5.16349481351424e-19 5.30216320004448e-19 5.412649299814848e-19 5.499359098532544e-19 5.566890843099265e-19 5.619330083898048e-19 5.659464608249088e-19 5.6892490716297605e-19 5.710734260114688e-19 5.726611830426816e-19 5.738900525108352e-19 5.748465519534528e-19 5.755755423159168e-19 5.761234867202304e-19 5.765416548182593e-19 5.768620901424192e-19 5.770863948693312e-19 5.771729124068544e-19 5.77120040578368e-19 5.769245750306305e-19 5.765048047559808e-19 5.757437708611008e-19 5.744908687436353e-19 5.7253781544288005e-19 5.696074344034368e-19 5.653744837712832e-19 5.594416237444608e-19 5.512721251550017e-19 5.401225780508544e-19 5.248954914467712e-19 5.039085798909121e-19 4.742138384010049e-19 4.3053209501151365e-19 3.6352906872965763e-19 2.5465155428657284e-19 5.917831610119297e-20 ] "source-value" [ 1.97624 2.43609 2.67061 2.84417 2.98696 3.11517 3.2228 3.30935 3.37831 3.43243 3.47458 3.50731 3.53236 3.55095 3.56436 3.57427 3.58194 3.58791 3.59246 3.59588 3.59849 3.60049 3.60189 3.60243 3.6021 3.60088 3.59826 3.59351 3.58569 3.5735 3.55521 3.52879 3.49176 3.44077 3.37118 3.27614 3.14515 2.95981 2.68717 2.26897 1.58941 0.369362 ] } "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 ] ] } "species" { "source-value" [ "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" "Ti" ] } "instance-id" 1 }