1. A general forcefield for accurate phonon properties of metal–organic frameworks. Issue 42 (12th October 2016) Authors: Bristow, Jessica K.; Skelton, Jonathan M.; Svane, Katrine L.; Walsh, Aron; Gale, Julian D. Journal: Physical chemistry chemical physics Issue: Volume 18:Issue 42(2016) Page Start: 29316 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. Chemical bonding at the metal–organic framework/metal oxide interface: simulated epitaxial growth of MOF-5 on rutile TiO2. Issue 13 (14th March 2017) Authors: Bristow, Jessica K.; Butler, Keith T.; Svane, Katrine L.; Gale, Julian D.; Walsh, Aron Journal: Journal of materials chemistry Issue: Volume 5:Issue 13(2017) Page Start: 6226 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. ChemInform Abstract: Computational Materials Design of Crystalline Solids. Issue 51 (5th December 2016) Authors: Butler, Keith T.; Frost, Jarvist M.; Skelton, Jonathan M.; Svane, Katrine L.; Walsh, Aron Journal: ChemInform Issue: Volume 47:Issue 51(2016) Page Start: no Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Computational materials design of crystalline solids. (18th March 2016) Authors: Butler, Keith T.; Frost, Jarvist M.; Skelton, Jonathan M.; Svane, Katrine L.; Walsh, Aron Journal: Chemical Society reviews Issue: Volume 45:Number 22(2016:Nov.) Page Start: 6138 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Heterometallic perovskite-type metal–organic framework with an ammonium cation: structure, phonons, and optical response of [NH4]Na0.5CrxAl0.5−x(HCOO)3 (x = 0, 0.025 and 0.5). Issue 34 (20th August 2018) Authors: Ptak, Maciej; Stefańska, Dagmara; Gągor, Anna; Svane, Katrine L.; Walsh, Aron; Paraguassu, Waldeci Journal: Physical chemistry chemical physics Issue: Volume 20:Issue 34(2018) Page Start: 22284 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Improving the Activity of M−N4 Catalysts for the Oxygen Reduction Reaction by Electrolyte Adsorption. Issue 23 (7th November 2019) Authors: Svane, Katrine L.; Reda, Mateusz; Vegge, Tejs; Hansen, Heine A. Journal: ChemSusChem Issue: Volume 12:Issue 23(2019) Page Start: 5133 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Magnetoelastic coupling in the cobalt adipate metal–organic framework from quasi-harmonic lattice dynamics. Issue 42 (5th October 2015) Authors: Svane, Katrine L.; Saines, Paul J.; Walsh, Aron Journal: Journal of materials chemistry Issue: Volume 3:Issue 42(2015) Page Start: 11076 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Passivation Properties and Formation Mechanism of Amorphous Halide Perovskite Thin Films. (17th February 2021) Authors: Rigter, Susan A.; Quinn, Xueying L.; Kumar, Rishi E.; Fenning, David P.; Massonnet, Philippe; Ellis, Shane R.; Heeren, Ron M. A.; Svane, Katrine L.; Walsh, Aron; Garnett, Erik C. Journal: Advanced functional materials Issue: Volume 31:Number 15(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Theoretical Optimization of Compositions of High‐Entropy Oxides for the Oxygen Evolution Reaction. (10th March 2022) Authors: Svane, Katrine L.; Rossmeisl, Jan Journal: Angewandte Chemie Issue: Volume 134:Number 19(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. Theoretical Optimization of Compositions of High‐Entropy Oxides for the Oxygen Evolution Reaction. Issue 19 (10th March 2022) Authors: Svane, Katrine L.; Rossmeisl, Jan Journal: Angewandte Chemie international edition Issue: Volume 61:Issue 19(2022) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗