| Transferable force field for metal–organic frameworks from first-principles: BTW-FF JK Bristow, D Tiana, A Walsh Journal of Chemical Theory and Computation 10 (10), 4644-4652, 2014 | 120 | 2014 |
| Vacancy defect configurations in the metal–organic framework UiO-66: energetics and electronic structure KL Svane, JK Bristow, JD Gale, A Walsh Journal of Materials Chemistry A 6 (18), 8507-8513, 2018 | 67 | 2018 |
| Free energy of ligand removal in the metal–organic framework uio-66 JK Bristow, KL Svane, D Tiana, JM Skelton, JD Gale, A Walsh The Journal of Physical Chemistry C 120 (17), 9276-9281, 2016 | 57 | 2016 |
| A general forcefield for accurate phonon properties of metal–organic frameworks JK Bristow, JM Skelton, KL Svane, A Walsh, JD Gale Physical Chemistry Chemical Physics 18 (42), 29316-29329, 2016 | 57 | 2016 |
| Defect chemistry of Ti and Fe impurities and aggregates in Al 2 O 3 JK Bristow, D Tiana, SC Parker, A Walsh Journal of Materials Chemistry A 2 (17), 6198-6208, 2014 | 41 | 2014 |
| Compositional control of pore geometry in multivariate metal–organic frameworks: an experimental and computational study LK Cadman, JK Bristow, NE Stubbs, D Tiana, MF Mahon, A Walsh, ... Dalton Transactions 45 (10), 4316-4326, 2016 | 30 | 2016 |
| Chemical bonding at the metal–organic framework/metal oxide interface: simulated epitaxial growth of MOF-5 on rutile TiO 2 JK Bristow, KT Butler, KL Svane, JD Gale, A Walsh Journal of Materials Chemistry A 5 (13), 6226-6232, 2017 | 26 | 2017 |
| Microscopic origin of the optical processes in blue sapphire JK Bristow, SC Parker, CRA Catlow, SM Woodley, A Walsh Chemical Communications 49 (46), 5259-5261, 2013 | 23 | 2013 |
| Ligand engineering in Cu (ii) paddle wheel metal–organic frameworks for enhanced semiconductivity MJ Golomb, J Calbo, JK Bristow, A Walsh Journal of Materials Chemistry A 8 (26), 13160-13165, 2020 | 13 | 2020 |
| Anharmonic origin of giant thermal displacements in the metal–organic framework UiO-67 KL Svane, JK Bristow, A Walsh The Journal of Physical Chemistry C 121 (40), 22010-22014, 2017 | 3 | 2017 |
| Ligand engineering in Cu (II) paddle wheel metal-organic frameworks for enhanced electrical conductivity M Golomb, J Calbo, JK Bristow, A Walsh | | 2020 |
| Anharmonic Origin of Giant J Bristow, A Walsh | | 2017 |
| Chemical bonding in metal-organic frameworks: from fundamentals to design principles JK Bristow University of Bath, 2016 | | 2016 |
| Transferable force field for metal-organic frameworks from first JK Bristow, D Tiana, A Walsh under an ACS AuthorChoice License, which permits, 2014 | | 2014 |
| Supporting information for: Transferable forcefield for metal-organic frameworks from first-principles: BTW-FF JK Bristow, D Tiana, A Walsh | | 2014 |
| Defect chemistry of Ti and Fe impurities and aggregates in Al₂O₃ JK Bristow, D Tiana, SC Parker, A Walsh | | 2014 |
| Supplementary Information for" Anharmonic Origin of Giant Thermal Displacements in the Metal-Organic Framework UiO-67 KL Svane, JK Bristow, A Walsh | | |
| Supporting information for: Free Energy of Ligand Removal in the Metal-Organic Framework UiO-66 JK Bristow, K Svane, D Tiana, JM Skelton, JD Gale, A Walsh | | |
