F. Bell

发表

Computational Studies on the Pt(II)-Catalyzed Cycloisomerization of 1,6-dienes into Bicyclopropanes: A Mechanistic Quandary Evaluated by DFT.

Jennifer C. Green, J. Holland, M. R. Gagné, 2009, Organometallics.

Restricted active space spin-flip configuration interaction: theory and examples for multiple spin flips with odd numbers of electrons.

M. Head‐Gordon, P. Zimmerman, A. Bell, 2012, The Journal of chemical physics.

Theoretical study of substituted PBPB dimers: structural analysis, tetraradical character, and excited states.

M. Head‐Gordon, D. Casanova, F. Bell, 2010, Journal of the American Chemical Society.

Dissociative photoionization of glycerol and its dimer occurs predominantly via a ternary hydrogen-bridged ion-molecule complex.

M. Head‐Gordon, S. Leone, Qiaoyun Ruan, 2013, Journal of the American Chemical Society.

Density functional theory based screening of ternary alkali-transition metal borohydrides: a computational material design project.

J Rossmeisl, A Tekin, G. D. Barmparis, 2009, The Journal of chemical physics.

Restricted active space spin-flip (RAS-SF) with arbitrary number of spin-flips.

M. Head‐Gordon, P. Zimmerman, D. Casanova, 2013, Physical chemistry chemical physics : PCCP.

Higher order singular value decomposition in quantum chemistry

Martin Head-Gordon, Daniel S. Lambrecht, M. Head‐Gordon, 2010 .

Mechanism for singlet fission in pentacene and tetracene: from single exciton to two triplets.

Paul M Zimmerman, David Casanova, Martin Head-Gordon, 2011, Journal of the American Chemical Society.

Kinetically constrained ring-polymer molecular dynamics for non-adiabatic chemical reactions.

Thomas F. Miller, Artur R. Menzeleev, F. Bell, 2014, The Journal of chemical physics.

Mechanism for singlet fission in pentacene and tetracene: from single exciton to two triplets.

M. Head‐Gordon, P. Zimmerman, D. Casanova, 2011, Journal of the American Chemical Society.

Kinetically constrained ring-polymer molecular dynamics for non-adiabatic chemical reactions.

Thomas F. Miller, Artur R. Menzeleev, F. Bell, 2014, The Journal of chemical physics.