{ "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" [ "W" "W" ] } "a" { "source-value" [ 4.71 4.394413 4.198824 4.056719 3.945041 3.853031 3.774788 3.706723 3.646491 3.592473 3.543506 3.498726 3.457473 3.419232 3.383592 3.350222 3.31885 3.289251 3.261235 3.23464 3.20933 3.185187 3.162106 3.14 3.117651 3.094621 3.070866 3.046339 3.020989 2.994757 2.967582 2.939391 2.910107 2.879642 2.847895 2.814754 2.780092 2.743762 2.705594 2.665394 2.622932 2.57794 2.530095 2.479012 2.42422 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.71e-10 4.3944130000000004e-10 4.1988240000000004e-10 4.0567190000000004e-10 3.945041e-10 3.853031e-10 3.774788e-10 3.7067230000000003e-10 3.6464910000000005e-10 3.592473e-10 3.543506e-10 3.498726e-10 3.457473e-10 3.4192320000000003e-10 3.383592e-10 3.3502220000000003e-10 3.31885e-10 3.289251e-10 3.2612350000000004e-10 3.23464e-10 3.20933e-10 3.185187e-10 3.162106e-10 3.14e-10 3.117651e-10 3.0946210000000003e-10 3.070866e-10 3.046339e-10 3.0209890000000003e-10 2.994757e-10 2.967582e-10 2.9393910000000004e-10 2.9101070000000003e-10 2.879642e-10 2.847895e-10 2.8147540000000003e-10 2.780092e-10 2.743762e-10 2.705594e-10 2.665394e-10 2.622932e-10 2.57794e-10 2.5300950000000004e-10 2.479012e-10 2.42422e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.87196 2.92167 3.78124 4.4754 5.06888 5.59223 6.04688 6.42673 6.74798 7.02272 7.26209 7.48159 7.69308 7.90101 8.09967 8.28162 8.44198 8.57857 8.69097 8.77534 8.83439 8.87256 8.89345 8.89998 8.89299 8.86971 8.81714 8.71462 8.54198 8.30349 8.02667 7.74284 7.46223 7.18166 6.89528 6.59398 6.27041 5.91463 5.51316 5.03439 4.36743 3.39849 2.17211 0.672195 -1.22046 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 2.99921057178264e-19 4.68103140625878e-19 6.058214375546159e-19 7.170381307803599e-19 8.121241096549919e-19 8.959740237953818e-19 9.688169844601918e-19 1.0296756639026819e-18 1.081145588269932e-18 1.1251637891124478e-18 1.1635150912005059e-18 1.198682868316806e-18 1.232567301949272e-18 1.2658813607000339e-18 1.2977102017110778e-18 1.326861805566708e-18 1.3525543100695318e-18 1.3744384407133378e-18 1.3924469060794979e-18 1.4059644703405559e-18 1.4154253233643261e-18 1.4215408315763039e-18 1.4248877785647299e-18 1.4259339999067319e-18 1.4248140784395658e-18 1.4210842112356138e-18 1.4126615686706759e-18 1.3962360538189079e-18 1.368576076409532e-18 1.3303657658652659e-18 1.2860143122828778e-18 1.240539732880056e-18 1.195581054353382e-18 1.1506287845332438e-18 1.1047456500887518e-18 1.056472068106332e-18 1.004630438759994e-18 9.476281984755418e-19 8.83305613150344e-19 8.065982024443259e-19 6.997394296630619e-19 5.444981268882659e-19 3.4801038884777395e-19 1.0769751224916299e-19 -1.95539249473164e-19 ] } }