modified on 15 April 2016 at 16:19 ••• 32,352 views

Developer Team

From NWChem

(Difference between revisions)
Jump to: navigation, search
(Created page with "==NWChem Core Developer Team== {| border='1' style="width: 100%" ! scope="col" style="width: 30%" align="left" | Name ! scope="col" style="width: 60%" align="left" | Current foc...")
Line 1: Line 1:
 +
__NOTITLE__
 +
=NWChem developer consortium=
 +
==NWChem Core Developer Team==
==NWChem Core Developer Team==

Revision as of 13:51, 27 January 2012

Contents

NWChem developer consortium

NWChem Core Developer Team

Name Current focus
W. A. de Jong Properties, relativistic effects, basis sets
E. J. Bylaska Plane wave development
N. Govind DFT, TDDFT, embedding methods for materials
K. Kowalski High accuracy methods
M. Valiev QM/MM methodologies
H. J. J. van Dam DFT, Fault tolerance
E. Apra DFT, Cray optimization
T. P. Straatsma Molecular dynamics

Active Developers

Name Current focus
R. J. Harrison (ORNL) Multiresolution methods
T. L. Windus (Iowa State University and AMES) Dynamic nucleation theory
J. R. Hammond (ANL) High accuracy response, IBM Blue Gene performance
J. Autschbach (SUNY Buffalo) Response properties, relativistic effects
L. Jensen (Penn State) DFT functionals, properties
M. Swart (Universitat de Girona, Spain) Improved DFT functionals
Q. Wu (BNL) Constrained DFT
T. Van Voorhis (MIT) Constrained DFT
Y. Zhao (Hewlett-Packard) Minnesota (Truhlar) functionals
A. Vazquez-Mayagoitia (ANL) DFT functionals, properties

Contributors and Inactive Developers

K. Glaesemann L. D. Crosby D. Wang P. Nichols S. Hirata M. T. Hackler P.-D. Fan M. Dupuis D. M. A. Smith A. Wong
V. Tipparaju M. Krishnan A. A. Auer M. Nooijen E. Brown G. Cisneros G. I. Fann Z. Zhang H. Fruchtl J. Garza
K. Hirao R. Kendall J. A. Nichols K. Tsemekhman K. Wolinski J. Anchell D. Bernholdt P. Borowski T. Clark D. Clerc
H. Dachsel M. Deegan K. G. Dyall D. Elwood E. Glendening M. Gutowski A. Hess J. Jaffe B. Johnson J. Ju
R. Kobayashi R. Kutteh Z. Lin R. Littlefield X. Long B. Meng T. Nakajima S. Niu L. Pollack M. Rosing
G. Sandrone M. Stave H. Taylor G. Thomas J. H. van Lenthe J. Nieplocha