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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. Green open access
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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. Green open access
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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. Green open access
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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. Green open access
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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). Green open access
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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. Green open access
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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. Green open access
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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. Green open access
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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. Green open access
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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). Green open access
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