{ "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" [ "Al" "Al" ] } "a" { "source-value" [ 4.9327 4.602192 4.397356 4.248531 4.131574 4.035214 3.953271 3.881988 3.818908 3.762336 3.711054 3.664157 3.620953 3.580904 3.543579 3.508631 3.475777 3.444778 3.415437 3.387585 3.361078 3.335793 3.311622 3.28847 3.272709 3.256121 3.238615 3.220083 3.200396 3.179403 3.156917 3.132709 3.106493 3.077906 3.046476 3.011575 2.972339 2.927538 2.875326 2.812757 2.73468 2.63078 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.9327e-10 4.602192e-10 4.397356e-10 4.248531e-10 4.131574e-10 4.035214e-10 3.953271e-10 3.8819880000000005e-10 3.818908e-10 3.762336e-10 3.711054e-10 3.664157e-10 3.620953e-10 3.580904e-10 3.543579e-10 3.5086309999999997e-10 3.475777e-10 3.444778e-10 3.415437e-10 3.387585e-10 3.361078e-10 3.335793e-10 3.311622e-10 3.28847e-10 3.272709e-10 3.2561209999999997e-10 3.2386149999999997e-10 3.220083e-10 3.200396e-10 3.1794030000000003e-10 3.156917e-10 3.132709e-10 3.106493e-10 3.077906e-10 3.0464760000000004e-10 3.011575e-10 2.972339e-10 2.927538e-10 2.875326e-10 2.812757e-10 2.73468e-10 2.63078e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 1.12596 1.59691 1.91186 2.16 2.36333 2.53245 2.67563 2.79974 2.90994 3.00956 3.10009 3.18158 3.25337 3.31493 3.36633 3.40819 3.44152 3.46747 3.48713 3.50155 3.51163 3.51818 3.52182 3.52296 3.52244 3.52078 3.51781 3.51331 3.50699 3.49844 3.48711 3.47213 3.45205 3.42437 3.38537 3.32926 3.24708 3.12455 2.93783 2.6447 2.16204 1.29076 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.8039867879559681e-19 2.558531867521728e-19 3.063137394242688e-19 3.4607015009280005e-19 3.786472073235264e-19 4.05743218334496e-19 4.2868318319111044e-19 4.485677972318592e-19 4.662237835930753e-19 4.821846670894849e-19 4.966891720375872e-19 5.097453093204864e-19 5.212473352812096e-19 5.311103345588544e-19 5.393455223897665e-19 5.460522337244352e-19 5.513922884015616e-19 5.555499367325377e-19 5.586998159690304e-19 5.610101546562241e-19 5.626251486899904e-19 5.636745743766144e-19 5.642577666665857e-19 5.644404148013568e-19 5.643571016170752e-19 5.640911402980224e-19 5.636152938416448e-19 5.628943143622849e-19 5.618817387379392e-19 5.605118777271552e-19 5.586966116157888e-19 5.562965510378305e-19 5.53079380383264e-19 5.486445554968896e-19 5.423960666757696e-19 5.334062536564608e-19 5.202395661867264e-19 5.006080960520641e-19 4.706922541884864e-19 4.23727650902976e-19 3.4639699412344324e-19 2.0680254950638079e-19 ] } }