Dennis M. Elking

Publication Activity (10 Years)

Years Active: 2007-2016
Publications (10 Years): 1

Top Topics

Simulated Annealing

Constrained Optimization

Top Venues

J. Comput. Chem.

Comput. Phys. Commun.

Publications

Dennis M. Elking
Torque and atomic forces for Cartesian tensor atomic multipoles with an application to crystal unit cell optimization. J. Comput. Chem. 37 (22) (2016)
Dennis M. Elking, Lalith E. Perera, Lee G. Pedersen
HPAM: Hirshfeld partitioned atomic multipoles. Comput. Phys. Commun. 183 (2) (2012)
Dennis M. Elking, Lalith E. Perera, Robert E. Duke, Thomas A. Darden, Lee G. Pedersen
A finite field method for calculating molecular polarizability tensors for arbitrary multipole rank. J. Comput. Chem. 32 (15) (2011)
Dennis M. Elking, Lalith E. Perera, Robert E. Duke, Thomas A. Darden, Lee G. Pedersen
Atomic forces for geometry-dependent point multipole and Gaussian multipole models. J. Comput. Chem. 31 (15) (2010)
Dennis M. Elking, Tom Darden, Robert J. Woods
Gaussian induced dipole polarization model. J. Comput. Chem. 28 (7) (2007)