Ab initio quantum chemistry and molecular dynamics simulations studies of LiPF6/poly(ethylene oxide) interactions. - Oleg Borodin; Grant D. Smith; Richard L. Jaffe (J. Comput. Chem., 2001)

A revised quantum chemistry-based potential for poly(ethylene oxide) and its oligomers in aqueous solution. - Grant D. Smith; Oleg Borodin; Dmitry Bedrov (J. Comput. Chem., 2002)