Kurt Brorsen
Graduate Student
Address
Research Interests
- Development in electronic structure theory for obtaining the wave function and properties of large molecules or molecular clusters
- Dynamics and bulk properties of molecular clusters
- Fragment molecular orbital molecular dynamics
(Chronologically most recent on top)Education
- Ph.D., Physical Chemistry, Iowa State University, 2013.
- B.S., Chemistry/Mathematics, University of Oklahoma, 2008.
(Chronologically most recent on top)Publications with the Ames Laboratory
2012
Brorsen K R; Minezawa N; Xu F; Windus T L; Gordon M S . 2012. Fragment Molecular Orbital Molecular Dynamics with the Fully Analytic Energy Gradient. Journal of Chemical Theory and Computation. 8:5008-5012. abstract Export: Tagged BibTex
2011
Nagata T; Brorsen K; Fedorov D G; Kitaura K; Gordon M S . 2011. Fully analytic energy gradient in the fragment molecular orbital method. Journal of Chemical Physics. 134:124115 . abstract Export: Tagged BibTex
