{"creator" "Junhao Li" "contributor-id" "c429164b-1b03-4ce3-a3a8-2568dd2bc449" "description" "Calculates lattice constant of hexagonal bulk structures at zero temperature and pressure by using simplex minimization to minimize the potential energy." "doi" "10.25950/25bcc28b" "domain" "openkim.org" "executables" ["runner" "test_template/runner"] "extended-id" "LatticeConstantHexagonalEnergy__TD_942334626465_004" "kim-api-version" "2.0" "maintainer-id" "c429164b-1b03-4ce3-a3a8-2568dd2bc449" "properties" ["tag:staff@noreply.openkim.org,2014-04-15:property/cohesive-free-energy-hexagonal-crystal" "tag:staff@noreply.openkim.org,2014-04-15:property/structure-hexagonal-crystal-npt"] "publication-year" "2018" "simulator-name" "ase" "title" "Equilibrium lattice constants for hexagonal bulk structures at zero temperature and pressure v004"}