Advances and applications in the FIREBALL ab initio tight‐binding molecular‐dynamics formalism JP Lewis, P Jelínek, J Ortega, AA Demkov, DG Trabada, B Haycock, ... physica status solidi (b) 248 (9), 1989-2007, 2011 | 260 | 2011 |
Nonadiabatic Ensemble Simulations of cis-Stilbene and cis-Azobenzene Photoisomerization AJ Neukirch, LC Shamberger, E Abad, BJ Haycock, H Wang, J Ortega, ... Journal of Chemical Theory and Computation 10 (1), 14-23, 2014 | 66 | 2014 |
The effect of electronic structure changes in NaInO 2 and NaIn 0.9 Fe 0.1 O 2 on the photoreduction of methylene blue JW Lekse, BJ Haycock, JP Lewis, DR Kauffman, C Matranga Journal of Materials Chemistry A 2 (24), 9331-9337, 2014 | 21 | 2014 |
Optical absorption and disorder in delafossites TR Senty, B Haycock, J Lekse, C Matranga, H Wang, G Panapitiya, ... Applied Physics Letters 111 (1), 2017 | 14 | 2017 |
High-throughput calculations of alloyed delafossite materials: Application to CuGa1− xFexO2 BJ Haycock, MK Rice, JP Lewis Computational materials science 86, 155-164, 2014 | 14 | 2014 |
High‐throughput evaluation in nitrogen doping of amorphous titanium dioxide BJ Haycock, G Lander, MK Rice, K Prasai, B Prasai, DA Drabold, ... physica status solidi (b) 251 (6), 1225-1230, 2014 | 3 | 2014 |
Metallization of the potassium overlayer on the β-SiC (100) c (4× 2) surface BJ Haycock, DG Trabada, J Ortega, JD O’Mahony, JP Lewis Journal of Physics: Condensed Matter 24 (48), 485001, 2012 | 1 | 2012 |
Failure of potassium dimer formation on the β‐SiC(100)‐c(4 × 2) surface B Haycock, J Ortega, JP Lewis physica status solidi (b) 248 (9), 2072-2075, 2011 | 1 | 2011 |
Calculation of the electronic and optical properties of nanoscale systems B Haycock Technological University Dublin, 2011 | 1 | 2011 |
Optical Absorption and Carrier Dynamics of Semiconductor Delafossites. R Sooriyagoda, TR Senty, B Haycock, J Lekse, C Matranga, H Wang, ... Bulletin of the American Physical Society 61, 2016 | | 2016 |
Optoelectronic properties of Fe impurities in delafossite oxide materials. A high-throughput investigation B Haycock, JP Lewis APS March Meeting Abstracts 2014, G27. 012, 2014 | | 2014 |
The effect of electronic structure changes in NaInO₂ and NaIn₀. ₉Fe₀. ₁O₂ on the photoreduction of methylene blue JW Lekse, BJ Haycock, JP Lewis, DR Kauffman, C Matranga | | 2014 |
Ensembles of light-induced conformational transformations between cis-stilbene (CS) and trans-stilbene (TS) from non-adiabatic molecular-dynamics simulations JP Lewis, L Shamberger, H Wang, B Haycock ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY 245, 2013 | | 2013 |
Strain Induced Photoabsorption of CuGaFeO MK Underwood, B Haycock, J Lewis, J Lekse, C Matranga Bulletin of the American Physical Society 58, 2013 | | 2013 |
Strain Induced Photoabsorption of CuGa1-xFexO2 M Underwood, B Haycock, J Lewis, J Lekse, C Matranga APS March Meeting Abstracts 2013, M5. 009, 2013 | | 2013 |
Electronic Structure of N-doped TiO J Lewis, B Haycock, G Lander, B Prasai, D Drabold APS March Meeting Abstracts 2013, U23. 012, 2013 | | 2013 |
High-Throughput Investigation of Delafossite materials B Haycock, M Kylee Underwood, J Lekse, C Matranga, JP Lewis APS March Meeting Abstracts 2013, Y25. 004, 2013 | | 2013 |
Potassium-induced semiconducting to metallic transition on the β-SiC (100) c (4x2) surface B Haycock APS March Meeting Abstracts 2011, T12. 002, 2011 | | 2011 |
Atomic Structure of the Si (111)-4x1-In System B Haycock, JD O'Mahony APS March Meeting Abstracts, W30. 008, 2008 | | 2008 |