{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-energy-relation-cubic-crystal" "instance-id" 1 "short-name" { "source-value" [ "fcc" ] } "species" { "source-value" [ "Sn" "Sn" "Sn" "Sn" ] } "a" { "source-value" [ 7.29002 6.801561 6.498834 6.278886 6.106034 5.963623 5.842521 5.737172 5.643945 5.560337 5.484548 5.415238 5.351388 5.292198 5.237036 5.185387 5.136831 5.091018 5.047654 5.006492 4.967318 4.929949 4.894226 4.86001 4.836717 4.812201 4.786329 4.75894 4.729846 4.69882 4.665588 4.62981 4.591066 4.548817 4.502367 4.450787 4.392801 4.326588 4.249425 4.156954 4.041564 3.88801 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 7.290020000000001e-10 6.801561000000001e-10 6.498834000000001e-10 6.278886000000001e-10 6.106034000000001e-10 5.963623e-10 5.842521e-10 5.737172e-10 5.643945e-10 5.560337e-10 5.484548000000001e-10 5.415238000000001e-10 5.351388e-10 5.292198e-10 5.237036e-10 5.185387e-10 5.136831e-10 5.091018e-10 5.047654e-10 5.006492e-10 4.967318e-10 4.929949e-10 4.894226e-10 4.86001e-10 4.836717000000001e-10 4.812201e-10 4.786329e-10 4.75894e-10 4.729846000000001e-10 4.698820000000001e-10 4.665588e-10 4.62981e-10 4.591066e-10 4.5488169999999996e-10 4.5023669999999997e-10 4.4507870000000003e-10 4.3928010000000004e-10 4.326588e-10 4.2494249999999995e-10 4.156954e-10 4.041564e-10 3.88801e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0 0.5 0.5 ] [ 0.5 0 0.5 ] [ 0.5 0.5 0 ] ] } "cohesive-potential-energy" { "source-value" [ 0.56887 0.899586 1.1766 1.4163 1.62716 1.81444 1.98171 2.13157 2.26603 2.38664 2.49468 2.59119 2.67706 2.75303 2.81976 2.87781 2.92769 2.96984 3.00465 3.03247 3.05364 3.06844 3.07715 3.08 3.07861 3.07403 3.06551 3.05209 3.03253 3.00523 2.96804 2.91809 2.8514 2.76239 2.643 2.48117 2.25817 1.94341 1.48375 0.778619 -0.385928 -2.55439 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 9.114302217835799e-20 1.441295669473524e-19 1.8851210275644e-19 2.2691627667341996e-19 2.6069977317794395e-19 2.9070533717949597e-19 3.17504945736414e-19 3.4151516477353797e-19 3.6305803179430203e-19 3.8238188417697594e-19 3.9969180053071193e-19 4.15154407225446e-19 4.28912297981604e-19 4.41084033870102e-19 4.51775358548784e-19 4.61075993909154e-19 4.69067650959546e-19 4.75820825471856e-19 4.8139800233481e-19 4.85855257730598e-19 4.89247065664776e-19 4.916182870830959e-19 4.930137829313099e-19 4.93470403272e-19 4.93247700719874e-19 4.92513903821502e-19 4.91148849329334e-19 4.88998728286506e-19 4.85864870790402e-19 4.81490928579582e-19 4.755324336777359e-19 4.67529561390906e-19 4.568446454187599e-19 4.425836711995259e-19 4.2345528436619993e-19 3.97527259898178e-19 3.6179872095997796e-19 3.11368609228194e-19 2.3772295806974996e-19 1.247485168588446e-19 -6.183248240063519e-20 -4.09258397212326e-19 ] } }