{ "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" [ "Pt" "Pt" "Pt" "Pt" ] } "a" { "source-value" [ 5.88 5.486018 5.241844 5.064439 4.925019 4.810154 4.712474 4.627502 4.552307 4.484871 4.42374 4.367837 4.316336 4.268595 4.224102 4.182443 4.143278 4.106326 4.07135 4.03815 4.006553 3.976411 3.947598 3.92 3.8921 3.863348 3.833692 3.803073 3.771425 3.738678 3.704752 3.669559 3.633 3.594967 3.555334 3.513961 3.470688 3.425333 3.377684 3.327498 3.274489 3.21832 3.15859 3.094818 3.026415 2.952658 2.872635 2.785182 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 5.88e-10 5.486018e-10 5.241844000000001e-10 5.064439000000001e-10 4.925019e-10 4.810154e-10 4.712474e-10 4.627502e-10 4.552307e-10 4.4848710000000003e-10 4.42374e-10 4.367837e-10 4.316336e-10 4.2685950000000006e-10 4.2241020000000006e-10 4.182443e-10 4.143278e-10 4.106326e-10 4.07135e-10 4.03815e-10 4.0065530000000004e-10 3.976411e-10 3.9475980000000003e-10 3.92e-10 3.8921000000000004e-10 3.863348e-10 3.8336920000000005e-10 3.803073e-10 3.7714249999999997e-10 3.7386780000000005e-10 3.704752e-10 3.6695590000000003e-10 3.6330000000000003e-10 3.5949670000000003e-10 3.555334e-10 3.5139610000000005e-10 3.470688e-10 3.425333e-10 3.377684e-10 3.327498e-10 3.274489e-10 3.21832e-10 3.1585899999999997e-10 3.094818e-10 3.026415e-10 2.952658e-10 2.872635e-10 2.785182e-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" [ 0.900906 1.51886 2.04339 2.50159 2.9076 3.27029 3.59581 3.88868 4.15241 4.38975 4.60298 4.79396 4.9643 5.11536 5.24832 5.36422 5.46398 5.54843 5.61828 5.67422 5.71683 5.74667 5.76424 5.77 5.76375 5.7434 5.70622 5.64894 5.56758 5.45738 5.31248 5.12578 4.8885 4.58981 4.21618 3.75063 3.17168 2.45191 1.55591 0.437539 -0.964115 -2.73056 -4.97253 -7.84295 -11.5574 -16.4265 -22.9102 -31.7091 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.443410542630404e-19 2.43348200231724e-19 3.27387171214926e-19 4.00798904584806e-19 4.6584887810184e-19 5.23958222440386e-19 5.76112276230354e-19 6.230352233103119e-19 6.652894276787939e-19 7.0331548791015e-19 7.374787002769319e-19 7.6807706963306395e-19 7.953685464166199e-19 8.19571026649824e-19 8.408735671754879e-19 8.59442794363548e-19 8.75426108464332e-19 8.889564901384619e-19 9.00147693926952e-19 9.09110270017548e-19 9.159371446550219e-19 9.20718039730878e-19 9.23533064076816e-19 9.24455917818e-19 9.2345455742175e-19 9.2019412797156e-19 9.14237235246348e-19 9.050599674867958e-19 8.92024658392572e-19 8.74368671885892e-19 8.511531324592319e-19 8.212404947024519e-19 7.832240475308999e-19 7.35368633649954e-19 6.755065080738119e-19 6.00917174877942e-19 5.08159158652512e-19 3.9283929106709396e-19 2.4928426466069395e-19 7.010147622637259e-20 -1.54468252548891e-19 -4.37483942973504e-19 -7.966871377864019e-19 -1.25657912316303e-18 -1.8516996229791598e-18 -2.6318154478401e-18 -3.67061871202668e-18 -5.08035791051694e-18 ] } }