{ "title" "Vacancy formation and migration energy for {{lattice}} {{elem}}{# FILENAME = kimspec.edn #}" "description" "Computes relaxed monovacancy formation and migration energy for {{lattice}} {{elem}} at zero temperature and zero pressure" "extended-id" "VacancyFormationMigration_{{lattice}}_{{elem}}__TE_{{kimnum}}_{{version}}" "test-driver" "{{TEST_DRIVER_NAME}}" "species" ["{{elem}}"] "developer" ["c429164b-1b03-4ce3-a3a8-2568dd2bc449"] "source-citations" [{"author" "J{\\'o}nsson, Hannes, Greg Mills, and Karsten W. Jacobsen" "title" "Nudged elastic band method for finding minimum energy paths of transitions" "booktitle" "Classical and quantum dynamics in condensed phase simulations" "year" "1998" "pages" "385--404"}] "contributor-id" "c429164b-1b03-4ce3-a3a8-2568dd2bc449" "maintainer-id" "4d62befd-21c4-42b8-a472-86132e6591f3" "matching-models" ["standard-models"] "publication-year" "2018" "kim-api-version" "2.2.1" "executables" ["runner"] "domain" "openkim.org" "matching-models" ["standard-models"] }