1. A fast charge‐Dependent atom‐pairwise dispersion correction for DFTB3. Issue 18 (26th February 2015) Authors: Petraglia, Riccardo; Steinmann, Stephan N.; Corminboeuf, Clemence; Eisenstein, Odile; Fliegl, Heike; Hopmann, Kathrin H.; Mennucci, Benedetta Journal: International journal of quantum chemistry Issue: Volume 115:Issue 18(2015:Sep. 19) Page Start: 1265 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
2. A fast charge‐Dependent atom‐pairwise dispersion correction for DFTB3. Issue 18 (26th February 2015) Authors: Petraglia, Riccardo; Steinmann, Stephan N.; Corminboeuf, Clemence Other Names: Eisenstein Odile guestEditor.; Fliegl Heike guestEditor.; Hopmann Kathrin H. guestEditor.; Mennucci Benedetta guestEditor. Journal: International journal of quantum chemistry Issue: Volume 115:Issue 18(2015:Sep. 19) Page Start: 1265 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
3. Adhesion of lubricant on aluminium through adsorption of additive head-groups on γ-alumina: A DFT study. (May 2020) Authors: Blanck, Sarah; Loehlé, Sophie; Steinmann, Stephan N.; Michel, Carine Journal: Tribology international Issue: Volume 145(2020) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
4. Atomistic modeling of electrocatalysis: Are we there yet?. (26th August 2020) Authors: Abidi, Nawras; Lim, Kang Rui Garrick; Seh, Zhi Wei; Steinmann, Stephan N. Journal: Wiley interdisciplinary reviews Issue: Volume 11:Number 3(2021) Page Start: n/a Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
5. Bonding analysis of planar hypercoordinate atoms via the generalized BLW‐LOL. Issue 26 (29th July 2013) Authors: Bomble, Laetitia; Steinmann, Stephan N.; Perez‐Peralta, Nancy; Merino, Gabriel; Corminboeuf, Clemence Journal: Journal of computational chemistry Issue: Volume 34:Issue 26(2013) Page Start: 2242 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
6. Bonding analysis of planar hypercoordinate atoms via the generalized BLW‐LOL. Issue 26 (29th July 2013) Authors: Bomble, Laetitia; Steinmann, Stephan N.; Perez‐Peralta, Nancy; Merino, Gabriel; Corminboeuf, Clemence Journal: Journal of computational chemistry Issue: Volume 34:Issue 26(2013) Page Start: 2242 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
7. Challenges in calculating the bandgap of triazine-based carbon nitride structures. Issue 10 (22nd February 2017) Authors: Steinmann, Stephan N.; Melissen, Sigismund T. A. G.; Le Bahers, Tangui; Sautet, Philippe Journal: Journal of materials chemistry Issue: Volume 5:Issue 10(2017) Page Start: 5115 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
8. Computational screening for selective catalysts: Cleaving the CC bond during ethanol electro-oxidation reaction. (1st June 2018) Authors: Monyoncho, Evans A.; Steinmann, Stephan N.; Sautet, Philippe; Baranova, Elena A.; Michel, Carine Journal: Electrochimica acta Issue: Volume 274(2018) Page Start: 274 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
9. Elucidating the role of electrochemical polarization on the selectivity of the CO2 hydrogenation reaction over Ru. (1st August 2020) Authors: Panaritis, Christopher; Michel, Carine; Couillard, Martin; Baranova, Elena A.; Steinmann, Stephan N. Journal: Electrochimica acta Issue: Volume 350(2020) Page Start: Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗
10. How machine learning can accelerate electrocatalysis discovery and optimization. Issue 2 (21st December 2022) Authors: Steinmann, Stephan N.; Wang, Qing; Seh, Zhi Wei Journal: Materials horizons Issue: Volume 10:Issue 2(2023) Page Start: 393 Record Type: Journal Article View Content: Available online (eLD content is only available in our Reading Rooms) ↗