{ "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" [ "Li" "Li" "Li" "Li" ] } "a" { "source-value" [ 6.59569 6.153755 5.879861 5.680863 5.524475 5.395628 5.28606 5.190745 5.106398 5.030754 4.962183 4.899475 4.841706 4.788154 4.738245 4.691516 4.647584 4.606135 4.566902 4.52966 4.494217 4.460407 4.428087 4.39713 4.365834 4.333583 4.300317 4.265971 4.230471 4.193737 4.155682 4.116205 4.075197 4.032534 3.988077 3.941668 3.893128 3.842252 3.788804 3.732509 3.673048 3.610042 3.543042 3.471507 3.394779 3.312043 3.22228 3.124183 3.016045 2.895573 2.759587 2.603493 2.420295 2.19856 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 6.59569e-10 6.153755e-10 5.879861000000001e-10 5.680863000000001e-10 5.524475e-10 5.395628e-10 5.286060000000001e-10 5.190745e-10 5.106398e-10 5.030754e-10 4.962182999999999e-10 4.899475e-10 4.841706000000001e-10 4.788154e-10 4.738245e-10 4.691516e-10 4.647584e-10 4.606135e-10 4.566902e-10 4.52966e-10 4.494217e-10 4.460407e-10 4.428087e-10 4.39713e-10 4.3658340000000006e-10 4.333583e-10 4.300317e-10 4.2659710000000006e-10 4.2304709999999996e-10 4.1937369999999996e-10 4.155682e-10 4.1162050000000003e-10 4.075197e-10 4.0325340000000003e-10 3.9880770000000003e-10 3.941668e-10 3.893128e-10 3.842252e-10 3.788804e-10 3.732509e-10 3.6730480000000004e-10 3.610042e-10 3.543042e-10 3.471507e-10 3.3947790000000005e-10 3.3120430000000003e-10 3.22228e-10 3.124183e-10 3.016045e-10 2.8955730000000005e-10 2.759587e-10 2.6034929999999997e-10 2.420295e-10 2.1985600000000002e-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" [ 0.970865 1.12827 1.23154 1.30773 1.36727 1.41541 1.4552 1.48856 1.51681 1.5409 1.55548 1.57063 1.58573 1.59864 1.60961 1.61887 1.62661 1.63297 1.6381 1.64211 1.64509 1.64713 1.6483 1.64868 1.64828 1.647 1.64472 1.64127 1.63649 1.63015 1.62202 1.61181 1.59908 1.58293 1.56403 1.54118 1.51362 1.48043 1.44045 1.39225 1.33402 1.2634 1.17736 1.07189 0.941572 0.779027 0.573902 0.311312 -0.0308183 -0.486471 -1.1104 -1.99604 -3.31506 -5.41612 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.5554972177684098e-19 1.8076878308431802e-19 1.97314461183636e-19 2.09521444958082e-19 2.1906080463691796e-19 2.26773682952994e-19 2.3314874377967997e-19 2.38493605030704e-19 2.43019754021754e-19 2.4687939753306e-19 2.4921537106543196e-19 2.5164266866594197e-19 2.54061955383282e-19 2.56130365417776e-19 2.5788795318527397e-19 2.59371568748358e-19 2.6061165346307395e-19 2.61630637802298e-19 2.6245255441553995e-19 2.6309502724577396e-19 2.6357247588270596e-19 2.63899319916042e-19 2.6408677458222e-19 2.6414765729431196e-19 2.64083570228952e-19 2.6387849161979998e-19 2.6351319534724797e-19 2.6296044440851796e-19 2.6219460397746596e-19 2.6117882399151e-19 2.5987625438806796e-19 2.58240432044754e-19 2.56200861189672e-19 2.53613345925762e-19 2.50585232087502e-19 2.46924258478812e-19 2.42508659675508e-19 2.3719103542726195e-19 2.3078553324452997e-19 2.2306304186865e-19 2.1373356732886797e-19 2.0241899593956e-19 1.8863386818062397e-19 1.7173571122182598e-19 1.508564657628648e-19 1.2481388566551179e-19 9.19492374605868e-20 4.987768122838079e-20 -4.93763601596022e-21 -7.794124693186139e-20 -1.7790569343936e-19 -3.19800864852936e-19 -5.311311672308039e-19 -8.677580910940079e-19 ] } }