Browse by UCL people
Group by: Type | Date
Jump to: Article
Number of items: 10.
Article
Escher, SGET;
Lazauskas, T;
Zwijnenburg, MA;
Woodley, SM;
(2018)
Synthesis target structures for alkaline earth oxide clusters.
Inorganics
, 6
(1)
, Article 29. 10.3390/inorganics6010029.
|
Escher, SGET;
Lazauskas, T;
Zwijnenburg, MA;
Woodley, SM;
(2017)
Structure prediction of (BaO)n nanoclusters for n⩽24 using an evolutionary algorithm.
Computational and Theoretical Chemistry
, 1107
pp. 74-81.
10.1016/j.comptc.2017.01.010.
|
Farrow, MR;
Buckeridge, J;
Lazauskas, T;
Mora-Fonz, D;
Scanlon, DO;
Catlow, CRA;
Woodley, SM;
(2017)
Heterostructures of GaN with SiC and ZnO enhance carrier stability and separation in framework semiconductors.
Physica Status Solidi (A) Applications and Materials Science
, 214
(4)
, Article 1600440. 10.1002/pssa.201600440.
|
Hou, Q;
Buckeridge, J;
Lazauskas, T;
Mora-Fonz, D;
Sokol, AA;
Woodley, SM;
Catlow, CRA;
(2018)
Defect formation in In2O3 and SnO2: a new atomistic approach based on accurate lattice energies.
Journal of Materials Chemistry C
, 6
(45)
pp. 12386-12395.
10.1039/c8tc04760j.
|
Lazauskas, T;
Sokol, AA;
Buckeridge, J;
Catlow, CRA;
Escher, SGET;
Farrow, MR;
Mora-Fonz, D;
... Woodley, SM; + view all
(2018)
Thermodynamically accessible titanium clusters TiN, N = 2-32.
Physical Chemistry Chemical Physics : PCCP
10.1039/c8cp00406d.
(In press).
|
Lazauskas, T;
Sokol, AA;
Woodley, SM;
(2019)
Are octahedral clusters missing on the carbon energy landscape?
Nanoscale Advances
, 1
(1)
pp. 89-93.
10.1039/c8na00013a.
|
Lazauskas, T;
Sokol, AA;
Woodley, SM;
(2017)
An efficient genetic algorithm for structure prediction at the nanoscale.
Nanoscale
, 9
(11)
pp. 3850-3864.
10.1039/c6nr09072a.
|
Mora-Fonz, D;
Lazauskas, T;
Farrow, MR;
Catlow, CRA;
Woodley, SM;
Sokol, AA;
(2017)
Why Are Polar Surfaces of ZnO Stable?
Chemistry of Materials
, 29
(12)
pp. 5306-5320.
10.1021/acs.chemmater.7b01487.
|
Mora-Fonz, D;
Lazauskas, T;
Woodley, SM;
Bromley, ST;
Catlow, CRA;
Sokol, AA;
(2017)
Development of Interatomic Potentials for Supported Nanoparticles: The Cu/ZnO Case.
The Journal of Physical Chemistry C
, 121
(31)
pp. 16831-16844.
10.1021/acs.jpcc.7b04502.
|
Woodley, SM;
Lazauskas, T;
Illingworth, M;
Carter, AC;
Sokol, AA;
(2018)
What is the best or most relevant global minimum for nanoclusters? Predicting, comparing and recycling cluster structures with WASP@N.
Faraday Discussions
10.1039/c8fd00060c.
(In press).
|