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HECATE: Hydrogen at Extreme Conditions: Applying Theory to Experiment for creation, verification and understanding
Ackland, Graeme
(Principal Investigator)
School of Physics and Astronomy
Overview
Fingerprint
Research output
(2)
Project Details
Status
Finished
Effective start/end date
1/10/16
→
31/03/23
Funding
European Commission:
£2,355,216.91
View all
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Fingerprint
Explore the research topics touched on by this project. These labels are generated based on the underlying awards/grants. Together they form a unique fingerprint.
Extreme Case
Engineering
100%
Methane
Engineering
100%
Energetics
Engineering
100%
melt
Chemistry
50%
Quadrupole
Chemistry
50%
Computer Simulation
Engineering
20%
Simple Point
Engineering
20%
Energy Engineering
Engineering
20%
Research output
Research output per year
2024
2024
2024
2
Article
Research output per year
Research output per year
Understanding solid nitrogen through molecular dynamics simulations with a machine-learning potential
Kirsz, M.
,
Pruteanu, C. G.
,
Cooke, P. I. C.
&
Ackland, G. J.
,
5 Nov 2024
,
In:
Physical Review B.
110
,
18
,
p. 1-14
14 p.
, 184107.
Research output
:
Contribution to journal
›
Article
›
peer-review
Open Access
Quadrupole
100%
melt
100%
Can the AMOEBA forcefield be used for high pressure simulations? The extreme case of methane and water
Kerr, M.
,
Ackland, G. J.
,
Marenduzzo, D.
,
Brandani, G. B.
&
Pruteanu, C. G.
,
7 Aug 2024
,
In:
The Journal of Chemical Physics.
161
,
5
,
p. 1-9
9 p.
, 054506.
Research output
:
Contribution to journal
›
Article
›
peer-review
Open Access
Methane
100%
Energetics
100%
Extreme Case
100%
Miscibility
25%
High Pressure Conditions
20%