Zobrazeno 1 - 2
of 2
pro vyhledávání: '"Miles J. Pemberton"'
Publikováno v:
Journal of Chemical Physics
A novel implementation for the calculation of molecular gradients under strong magnetic fields is employed at the current-density functional theory level to optimize the geometries of molecular structures, which change significantly under these condi
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d7e5dadd4615212b920d165fec80f73f
https://nottingham-repository.worktribe.com/file/7839572/1/StructureSearch
https://nottingham-repository.worktribe.com/file/7839572/1/StructureSearch
Publikováno v:
Journal of Chemical Physics; 5/28/2022, Vol. 156 Issue 20, p1-10, 10p
