Theoretical investigations of the rotational barrier in anisole: An ab initio and molecular dynamics study
- David C. Spellmeyer
- Peter D. J. Grootenhuis
- et al.
- 2002
- Journal of Physical Chemistry
This is our catalog of publications authored by IBM researchers, in collaboration with the global research community. It’s an ever-growing body of work that shows why IBM is one of the most important contributors to modern computing.