| Report on the sixth blind test of organic crystal structure prediction methods AM Reilly, RI Cooper, CS Adjiman, S Bhattacharya, AD Boese, ... Acta Crystallographica Section B: Structural Science, Crystal Engineering …, 2016 | 594 | 2016 |
| Functional materials discovery using energy–structure–function maps A Pulido, L Chen, T Kaczorowski, D Holden, MA Little, SY Chong, ... Nature 543 (7647), 657-664, 2017 | 421 | 2017 |
| Near-Ideal Xylene Selectivity in Adaptive Molecular Pillar[n]arene Crystals K Jie, M Liu, Y Zhou, MA Little, A Pulido, SY Chong, A Stephenson, ... Journal of the American Chemical Society 140 (22), 6921-6930, 2018 | 199 | 2018 |
| Ketonic decarboxylation reaction mechanism: a combined experimental and DFT study A Pulido, B Oliver‐Tomas, M Renz, M Boronat, A Corma ChemSusChem 6 (1), 141-151, 2013 | 142 | 2013 |
| Reticular synthesis of porous molecular 1D nanotubes and 3D networks AG Slater, MA Little, A Pulido, SY Chong, D Holden, L Chen, C Morgan, ... Nature Chemistry 9 (1), 17-25, 2017 | 128 | 2017 |
| Combined volumetric, infrared spectroscopic and theoretical investigation of CO2 adsorption on Na-A zeolite A Zukal, CO Arean, MR Delgado, P Nachtigall, A Pulido, J Mayerová, ... Microporous and mesoporous materials 146 (1-3), 97-105, 2011 | 104 | 2011 |
| Experimental and theoretical determination of adsorption heats of CO 2 over alkali metal exchanged ferrierites with different Si/Al ratio A Zukal, A Pulido, B Gil, P Nachtigall, O Bludský, M Rubeš, J Čejka Physical Chemistry Chemical Physics 12 (24), 6413-6422, 2010 | 92 | 2010 |
| Effect of the germanium incorporation in the synthesis of EU-1, ITQ-13, ITQ-22, and ITQ-24 zeolites G Sastre, A Pulido, R Castañeda, A Corma The Journal of Physical Chemistry B 108 (26), 8830-8835, 2004 | 92 | 2004 |
| Combined DFT/CC and IR spectroscopic studies on carbon dioxide adsorption on the zeolite H-FER A Pulido, MR Delgado, O Bludský, M Rubeš, P Nachtigall, CO Areán Energy & Environmental Science 2 (11), 1187-1195, 2009 | 90 | 2009 |
| Adsorption of CO2 on Sodium-Exchanged Ferrierites: The Bridged CO2 Complexes Formed between Two Extraframework Cations A Pulido, P Nachtigall, A Zukal, I Domínguez, J Čejka The Journal of Physical Chemistry C 113 (7), 2928-2935, 2009 | 89 | 2009 |
| Computationally-guided synthetic control over pore size in isostructural porous organic cages AG Slater, PS Reiss, A Pulido, MA Little, DL Holden, L Chen, SY Chong, ... ACS Central Science 3 (7), 734-742, 2017 | 79 | 2017 |
| Computational and Fourier transform infrared spectroscopic studies on carbon monoxide adsorption on the zeolites Na-ZSM-5 and K-ZSM-5: evidence of dual-cation sites CO Areán, MR Delgado, K Frolich, R Bulanek, A Pulido, GF Bibiloni, ... The Journal of Physical Chemistry C 112 (12), 4658-4666, 2008 | 74 | 2008 |
| Aerobic epoxidation of propene over silver (1 1 1) and (1 0 0) facet catalysts A Pulido, P Concepción, M Boronat, A Corma Journal of catalysis 292, 138-147, 2012 | 66 | 2012 |
| From concept to crystals via prediction: Multi‐component organic cage pots by social self‐sorting RL Greenaway, V Santolini, A Pulido, MA Little, BM Alston, ME Briggs, ... Angewandte Chemie International Edition 58 (45), 16275-16281, 2019 | 64 | 2019 |
| Guía metodológica para la elaboración de guías de práctica clínica con evaluación económica en el Sistema General de Seguridad Social en Salud Colombiano G Carrasquilla, A Pulido, A De la Hoz, K Mieth, O Muñoz, R Guerrero Bogotá: Ministerio de Salud y Protección Social, 2014 | 60 | 2014 |
| Periodic DFT investigation of the effect of aluminium content on the properties of the acid zeolite H-FER L Grajciar, CO Areán, A Pulido, P Nachtigall Physical Chemistry Chemical Physics 12 (7), 1497-1506, 2010 | 60 | 2010 |
| Average minimum distances of periodic point sets–foundational invariants for mapping periodic crystals D Widdowson, MM Mosca, A Pulido, AI Cooper, V Kurlin MATCH Commun. Math. Comput. Chem 87 (3), 529-559, 2022 | 57 | 2022 |
| Photocatalytic proton reduction by a computationally identified, molecular hydrogen-bonded framework CM Aitchison, CM Kane, DP McMahon, PR Spackman, A Pulido, X Wang, ... Journal of materials chemistry A 8 (15), 7158-7170, 2020 | 54 | 2020 |
| Computational Study of 19F NMR Spectra of Double Four Ring‐Containing Si/Ge‐Zeolites A Pulido, G Sastre, A Corma ChemPhysChem 7 (5), 1092-1099, 2006 | 54 | 2006 |
| Hydrogen adsorption on the zeolite Ca-A: DFT and FT-IR investigation CO Areán, GT Palomino, MRL Carayol, A Pulido, M Rubeš, O Bludský, ... Chemical Physics Letters 477 (1-3), 139-143, 2009 | 48 | 2009 |
