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Network: Mathematical Challenges of Molecular Dynamics - a chemo mathematical forum
Leimkuhler, Benedict
(Principal Investigator)
Ackland, Graeme
(Co-investigator)
School of Mathematics
School of Physics and Astronomy
Overview
Research output
(10)
Project Details
Status
Finished
Effective start/end date
1/04/08
→
31/03/11
Funding
EPSRC:
£5,700.00
EPSRC:
£23,100.00
View all
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Research output
Research output per year
2008
2012
8
Article
2
Conference contribution
Research output per year
Research output per year
Pseudopotential errors in titanium
Tegner, B. E. &
Ackland, G. J.
,
Feb 2012
,
In:
Computational Materials Science.
52
,
1
,
p. 26
5 p.
Research output
:
Contribution to journal
›
Article
›
peer-review
The MOLDY short-range molecular dynamics package
Ackland, G. J.
,
D'Mellow, K.
, Daraszewicz, S. L., Hepburn, D. J., Uhrin, M. &
Stratford, K.
,
Dec 2011
,
In:
Computer Physics Communications.
182
,
12
,
p. 2587-2604
18 p.
Research output
:
Contribution to journal
›
Article
›
peer-review
Twinning hierarchy, shape memory, and superelasticity demonstrated by molecular dynamics
Zelazny, M., Richardson, R. &
Ackland, G.
,
18 Oct 2011
,
In:
Physical Review B: Condensed Matter and Materials Physics.
84
,
14
,
p. -
7 p.
, 144113.
Research output
:
Contribution to journal
›
Article
›
peer-review