Furio Cora
Furio Cora
Professor of Computational Chemistry, UCL
Verified email at ucl.ac.uk
Title
Cited by
Cited by
Year
Modular and predictable assembly of porous organic molecular crystals
JTA Jones, T Hasell, X Wu, J Bacsa, KE Jelfs, M Schmidtmann, SY Chong, ...
Nature 474 (7351), 367-371, 2011
3642011
Electronic and structural properties of two-dimensional carbon nitride graphenes
M Deifallah, PF McMillan, F Cora
The Journal of Physical Chemistry C 112 (14), 5447-5453, 2008
3222008
H2 and O2 Evolution from Water Half-Splitting Reactions by Graphitic Carbon Nitride Materials
AB Jorge, DJ Martin, MTS Dhanoa, AS Rahman, N Makwana, J Tang, ...
The Journal of Physical Chemistry C 117 (14), 7178-7185, 2013
2882013
The performance of hybrid density functionals in solid state chemistry
F CorÓ, M Alfredsson, G Mallia, DS Middlemiss, WC Mackrodt, R Dovesi, ...
Principles and Applications of Density Functional Theory in Inorganicá…, 2004
2342004
Comparison of the bulk and surface properties of ceria and zirconia by ab initio investigations
S Gennard, F Cora, CRA Catlow
The Journal of Physical Chemistry B 103 (46), 10158-10170, 1999
1741999
The performance of hybrid density functionals in solid state chemistry: the case of BaTiO3
F CorÓ*
Molecular Physics 103 (18), 2483-2496, 2005
1592005
Flexibility in a metal–organic framework material controlled by weak dispersion forces: the bistability of MIL‐53 (Al)
AM Walker, B Civalleri, B Slater, C Mellot‐Draznieks, F CorÓ, ...
Angewandte Chemie 122 (41), 7663-7665, 2010
1552010
Carbon nitrides: synthesis and characterization of a new class of functional materials
TS Miller, AB Jorge, TM Suter, A Sella, F CorÓ, PF McMillan
Physical Chemistry Chemical Physics 19 (24), 15613-15638, 2017
1402017
Chemical and Structural Stability of Zirconium‐based Metal–Organic Frameworks with Large Three‐Dimensional Pores by Linker Engineering
SB Kalidindi, S Nayak, ME Briggs, S Jansat, AP Katsoulidis, GJ Miller, ...
Angewandte Chemie International Edition 54 (1), 221-226, 2015
1212015
Transition Metal Oxide Chemistry:  Electronic Structure Study of WO3, ReO3, and NaWO3
F Cora, MG Stachiotti, CRA Catlow, CO Rodriguez
The Journal of Physical Chemistry B 101 (20), 3945-3952, 1997
1211997
An ab Initio Hartree−Fock Study of the Cubic and Tetragonal Phases of Bulk Tungsten Trioxide
F Cora, A Patel, NM Harrison, R Dovesi, CRA Catlow
Journal of the American Chemical Society 118 (48), 12174-12182, 1996
1171996
Anab initio Hartree–Fock study of α-MoO 3
F CorÓ, A Patel, NM Harrison, C Roetti, CRA Catlow
Journal of Materials Chemistry 7 (6), 959-967, 1997
971997
Sorption-induced breathing in the flexible metal organic framework CrMIL-53: force-field simulations and electronic structure analysis
DS Coombes, F Cora, C Mellot-Draznieks, RG Bell
The Journal of Physical Chemistry C 113 (2), 544-552, 2009
842009
Hartree-Fock perturbed-cluster treatment of local defects in crystals: I. The EMBED program: general features
C Pisani, F CorÓ, R Nada, R Orlando
Computer physics communications 82 (2-3), 139-156, 1994
821994
Graphitic carbon nitride C6N9H3Ě HCl: Characterisation by UV and near-IR FT Raman spectroscopy
PF McMillan, V Lees, E Quirico, G Montagnac, A Sella, B Reynard, ...
Journal of Solid State Chemistry 182 (10), 2670-2677, 2009
752009
QM investigations on perovskite-structured transition metal oxides: bulk, surfaces and interfaces
F Cora, CRA Catlow
Faraday Discussions 114, 421-442, 1999
661999
Graphitic carbon nitride as a catalyst support in fuel cells and electrolyzers
N Mansor, TS Miller, I Dedigama, AB Jorge, J Jia, V Brßzdovß, C Mattevi, ...
Electrochimica Acta 222, 44-57, 2016
642016
Computational study of the structure-directing effect of benzylpyrrolidine and its fluorinated derivatives in the synthesis of the aluminophosphate AlPO-5
L Gˇmez-HortigŘela, F CorÓ, CRA Catlow, J PÚrez-Pariente
Journal of the American Chemical Society 126 (38), 12097-12102, 2004
622004
First-principles investigation of sand related oxides
MG Stachiotti, F CorÓ, CRA Catlow, CO Rodriguez
Physical Review B 55 (12), 7508, 1997
601997
A polar corundum oxide displaying weak ferromagnetism at room temperature
MR Li, U Adem, SRC McMitchell, Z Xu, CI Thomas, JE Warren, DV Giap, ...
Journal of the American Chemical Society 134 (8), 3737-3747, 2012
592012
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