{ "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" [ "Ag" "Ag" ] } "a" { "source-value" [ 4.85382 4.528596 4.327035 4.180591 4.065503 3.970684 3.890051 3.819908 3.757837 3.702169 3.651707 3.60556 3.563047 3.523638 3.48691 3.452521 3.420192 3.389689 3.360817 3.33341 3.307327 3.282446 3.258662 3.23588 3.212849 3.189115 3.164635 3.139359 3.113234 3.086202 3.058197 3.029146 2.998968 2.967572 2.934856 2.900703 2.864982 2.827542 2.788209 2.746782 2.703024 2.656657 2.607352 2.554709 2.498244 2.437359 2.371301 2.299111 2.219532 2.130876 2.030803 1.915933 1.781116 1.61794 ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ 4.853819999999999e-10 4.5285960000000005e-10 4.3270350000000005e-10 4.1805909999999997e-10 4.065503e-10 3.970684e-10 3.890051e-10 3.819908e-10 3.757837e-10 3.7021690000000003e-10 3.651707e-10 3.60556e-10 3.563047e-10 3.5236380000000003e-10 3.48691e-10 3.452521e-10 3.4201920000000003e-10 3.3896890000000003e-10 3.360817e-10 3.33341e-10 3.307327e-10 3.282446e-10 3.258662e-10 3.23588e-10 3.212849e-10 3.189115e-10 3.1646350000000004e-10 3.139359e-10 3.113234e-10 3.0862020000000003e-10 3.058197e-10 3.029146e-10 2.9989680000000003e-10 2.967572e-10 2.934856e-10 2.900703e-10 2.864982e-10 2.8275420000000003e-10 2.788209e-10 2.746782e-10 2.7030240000000003e-10 2.656657e-10 2.6073520000000004e-10 2.554709e-10 2.4982440000000003e-10 2.437359e-10 2.371301e-10 2.299111e-10 2.219532e-10 2.1308760000000002e-10 2.0308030000000003e-10 1.9159330000000003e-10 1.7811159999999999e-10 1.61794e-10 ] } "basis-atom-coordinates" { "source-value" [ [ 0 0 0 ] [ 0.5 0.5 0.5 ] ] } "cohesive-potential-energy" { "source-value" [ 0.741256 1.06948 1.33007 1.54856 1.73681 1.90145 2.04692 2.17606 2.29107 2.39361 2.485 2.5663 2.63837 2.70192 2.75761 2.80601 2.84758 2.88265 2.91157 2.93466 2.95221 2.96446 2.97166 2.97403 2.97147 2.96314 2.94796 2.92462 2.89154 2.8468 2.78802 2.71234 2.61621 2.49527 2.34404 2.15562 1.92143 1.63023 1.26745 0.814205 0.245315 -0.472978 -1.3872 -2.56213 -4.08985 -6.10459 -8.80818 -12.5136 -17.7266 -25.3053 -36.7967 -55.2142 -87.077 -148.705 ] "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" [ 1.187623043012304e-19 1.71349586653032e-19 2.13100707558438e-19 2.4810666483470396e-19 2.7826763996975397e-19 3.0464587607193e-19 3.27952739566728e-19 3.48643248618204e-19 3.6706988208583795e-19 3.8349860129087396e-19 3.9814089354899997e-19 4.1116658958341996e-19 4.2271347658465797e-19 4.3289530909372793e-19 4.41817830768474e-19 4.49572365677034e-19 4.562326139445719e-19 4.6185144740001e-19 4.66484942225538e-19 4.70184368073444e-19 4.72996188066114e-19 4.749588544427639e-19 4.76112421619244e-19 4.76492137481502e-19 4.760819802631979e-19 4.74747367127076e-19 4.72315262996664e-19 4.68575782732908e-19 4.63275782427636e-19 4.5610764416712e-19 4.46690049912468e-19 4.34564777146356e-19 4.1916305316371397e-19 3.99786328952118e-19 3.75556611716136e-19 3.4536839957830796e-19 3.0784702498666196e-19 2.61191641404582e-19 2.0306787747633e-19 1.3045002262859697e-19 3.9303796096971e-20 -7.57794299996052e-20 -2.2225394266847997e-19 -4.1049848192704192e-19 -6.5526621065649e-19 -9.780631458150059e-19 -1.411226018406612e-18 -2.00489975272224e-18 -2.84011443202644e-18 -4.0543560376360196e-18 -5.89548129483078e-18 -8.846290110500279e-18 -1.39512734758818e-17 -2.3825167635897002e-17 ] } }