activity
19992008
most citedAb initio supercell calculations on nitrogen-vacancy center in diamond: its electronic structure and hyperfine tensors

303 citations · 556 across the 7 of their papers we have counts for

collaborators
Showing 2007 · physics.comp-phShow all

1 paper · 2 filters

physics.comp-ph2007

Parallel multiscale modeling of biopolymer dynamics with hydrodynamic correlations

Maria Fyta, Jayanta Sircar, Efthimios Kaxiras +3

We employ a multiscale approach to model the translocation of biopolymers through nanometer size pores. Our computational scheme combines microscopic Molecular Dynamics (MD) with a…