William L. Hase

According to our database, William L. Hase authored at least 9 papers between 2002 and 2019.

Collaborative distances:

• Dijkstra number of five.
• Erdős number of four.

2019

Addressing an instability in unrestricted density functional theory direct dynamics simulations.

Shreyas Malpathak, Xinyou Ma, William L. Hase

J. Comput. Chem., 2019

2017

Data Reduction Through Increased Data Utilization in Chemical Dynamics Simulations.

Misha Ahmadian, Yu Zhuang, William L. Hase, Yong Chen

Big Data Res., 2017

2014

The VENUS/NWChem software package. Tight coupling between chemical dynamics simulations and electronic structure theory.

Upakarasamy Lourderaj, Rui Sun, Swapnil C. Kohale, George L. Barnes, Wibe A. de Jong, Theresa L. Windus, William L. Hase

Comput. Phys. Commun., 2014

Towards Efficient Direct Semiclassical Molecular Dynamics for Complex Molecular Systems.

Yu Zhuang, Michele Ceotto, William L. Hase

Proceedings of the Annual Conference of the Extreme Science and Engineering Discovery Environment, 2014

2013

A Load-Balancing Force Decomposition Scheme for Parallel Simulation of Chemical Dynamics with Multiple Inter-atomic Force Models.

Yu Zhuang, R. Rajagopalan, William L. Hase, Upakarasamy Lourderaj

Proceedings of the 16th IEEE International Conference on Computational Science and Engineering, 2013

2004

Experiments with Parallelizing Tribology Simulations.

Vipin Chaudhary, William L. Hase, Hai Jiang, L. Sun, Darshan Thaker

J. Supercomput., 2004

2003

Direct dynamics simulations.

William L. Hase, Kihyung Song, Mark S. Gordon

Comput. Sci. Eng., 2003

Computational chemistry.

William L. Hase, Gustavo E. Scuseria

Comput. Sci. Eng., 2003

2002

Experiments with Parallelizing a Tribology Application.

Vipin Chaudhary, William L. Hase, Hai Jiang, L. Sun, Darshan Thaker

Proceedings of the 31st International Conference on Parallel Processing Workshops (ICPP 2002 Workshops), 2002