John H. Weare

Publication Activity (10 Years)

Years Active: 1995-2017
Publications (10 Years): 1

Top Topics

Molecular Dynamics

Quantum Mechanics

Top Venues

J. Comput. Chem.

Publications

Teerapong Pirojsirikul, Andreas W. Götz, John H. Weare, Ross C. Walker, Karol Kowalski, Marat Valiev
Combined quantum-mechanical molecular mechanics calculations with NWChem and AMBER: Excited state properties of green fluorescent protein chromophore analogue in aqueous solution. J. Comput. Chem. 38 (18) (2017)
Eric J. Bylaska, Kiril Tsemekhman, Scott B. Baden, John H. Weare, Hannes Jónsson
Parallel implementation of gamma-point pseudopotential plane-wave DFT with exact exchange. J. Comput. Chem. 32 (1) (2011)
Scott R. Kohn, John H. Weare, Maria Elizabeth G. Ong, Scott B. Baden
Parallel Adaptive Mesh Refinement for Electronic Structure Calculations. PPSC (1997)
Eric J. Bylaska, Scott R. Kohn, Scott B. Baden, Alan Edelman, Ryoichi Kawai, M. Elizabeth G. Ong, John H. Weare
Scalable Parallel Numerical Methods and Software Tools for Material Design. PPSC (1995)