Jeremy Harvey

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Adrian MulhollandProfessor of Chemistry, University of BristolAdresse e-mail validée de bristol.ac.uk
Helmut SchwarzProfesssor für ChemieAdresse e-mail validée de tu-berlin.de
Varinder AggarwalProfessor of Chemistry, Bristol UniversityAdresse e-mail validée de bristol.ac.uk
david glowackiInvestigador Dinstinguido, CiTIUSAdresse e-mail validée de usc.es
Andrew Orr-EwingProfessor of Physical Chemistry, University of BristolAdresse e-mail validée de bristol.ac.uk
Guy Lloyd-Jones FRSForbes Professor, University of EdinburghAdresse e-mail validée de ed.ac.uk
Jesus JoverUniversitat de BarcelonaAdresse e-mail validée de ub.edu
Rinaldo PoliInstitut National Polytechnique de ToulouseAdresse e-mail validée de lcc-toulouse.fr
Richard LonsdaleGlaxoSmithKlineAdresse e-mail validée de gsk.com
Massimiliano AschiProfessor of ChemistryAdresse e-mail validée de univaq.it
Raphaël RobietteF.R.S.-FNRS, Université catholique de LouvainAdresse e-mail validée de uclouvain.be
Fred ManbyIambic TherapeuticsAdresse e-mail validée de iambic.ai
Mike AshfoldProfessor of Physical Chemistry, University of BristolAdresse e-mail validée de bristol.ac.uk
Julianna OlahAssociate professor, Budapest University of Technology and EconomicsAdresse e-mail validée de vbk.bme.hu
Stéphanie (Labouille) EssafiPostdoc, ENS, ParisAdresse e-mail validée de ens.fr
Paul W. MayUniversity of BristolAdresse e-mail validée de bristol.ac.uk
Maria BesoraUniversitat Rovira i VirgiliAdresse e-mail validée de urv.cat
Steven De FeyterKU Leuven, Department of ChemistryAdresse e-mail validée de chem.kuleuven.be
Zhen LiuEast China University of Science and Technology.Adresse e-mail validée de ecust.edu.cn
Claire L. McMullinSenior Lecturer - University of BathAdresse e-mail validée de bath.ac.uk

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Jeremy Harvey

KU Leuven

Adresse e-mail validée de kuleuven.be

Computational Chemistry


Titre Trier par citations Trier par année Trier par titre	Citée par Citée par	Année
The singlet and triplet states of phenyl cation. A hybrid approach for locating minimum energy crossing points between non-interacting potential energy surfaces JN Harvey, M Aschi, H Schwarz, W Koch Theoretical Chemistry Accounts 99, 95-99, 1998	975	1998
Radicals in organic synthesis P Renaud Radicals in Organic Synthesis 1, 2001	783	2001
Mechanism of the Hydrogenation of Ketones Catalyzed by trans-Dihydrido(diamine)ruthenium(II) Complexes K Abdur-Rashid, SE Clapham, A Hadzovic, JN Harvey, AJ Lough, ... Journal of the American Chemical Society 124 (50), 15104-15118, 2002	577	2002
Spin forbidden chemical reactions of transition metal compounds. New ideas and new computational challenges R Poli, JN Harvey Chemical Society Reviews 32 (1), 1-8, 2003	504	2003
Understanding the kinetics of spin-forbidden chemical reactions JN Harvey Physical Chemistry Chemical Physics 9 (3), 331-343, 2007	455	2007
On the accuracy of density functional theory in transition metal chemistry JN Harvey Annual Reports Section" C"(Physical Chemistry) 102, 203-226, 2006	419	2006
When and how do diaminocarbenes dimerize? RW Alder, ME Blake, L Chaker, JN Harvey, F Paolini, J Schütz Angewandte Chemie International Edition 43 (44), 5896-5911, 2004	359	2004
Understanding the reactivity of transition metal complexes involving multiple spin states JN Harvey, R Poli, KM Smith Coordination chemistry reviews 238, 347-361, 2003	358	2003
High-accuracy computation of reaction barriers in enzymes F Claeyssens, JN Harvey, FR Manby, RA Mata, AJ Mulholland, ... ANGEWANDTE CHEMIE-INTERNATIONAL EDITION IN ENGLISH- 45 (41), 6856, 2006	345	2006
Spin-forbidden dehydrogenation of methoxy cation: a statistical view JN Harvey, M Aschi Physical Chemistry Chemical Physics 1 (24), 5555-5563, 1999	320	1999
Mechanism of the Morita− Baylis− Hillman reaction: A computational investigation R Robiette, VK Aggarwal, JN Harvey Journal of the American Chemical Society 129 (50), 15513-15525, 2007	294	2007
DFT computation of relative spin-state energetics of transition metal compounds N Kaltsoyannis, JE McGrady, JN Harvey Principles and applications of density functional theory in inorganic …, 2004	289	2004
Assembly-line synthesis of organic molecules with tailored shapes M Burns, S Essafi, JR Bame, SP Bull, MP Webster, S Balieu, JW Dale, ... Nature 513 (7517), 183-188, 2014	287	2014
Taking Ockham's razor to enzyme dynamics and catalysis DR Glowacki, JN Harvey, AJ Mulholland Nature chemistry 4 (3), 169-176, 2012	279	2012
Aryl trifluoroborates in Suzuki–Miyaura coupling: the roles of endogenous aryl boronic acid and fluoride M Butters, JN Harvey, J Jover, AJJ Lennox, GC Lloyd‐Jones, PM Murray Angewandte Chemie 30 (122), 5282-5286, 2010	272	2010
Building ligand knowledge bases for organometallic chemistry: Computational description of phosphorus (III)-donor ligands and the metal–phosphorus bond N Fey, AG Orpen, JN Harvey Coordination Chemistry Reviews 253 (5-6), 704-722, 2009	255	2009
Reactivity and selectivity in the Wittig reaction: A computational study R Robiette, J Richardson, VK Aggarwal, JN Harvey Journal of the American Chemical Society 128 (7), 2394-2409, 2006	240	2006
Spin‐forbidden reactions: computational insight into mechanisms and kinetics JN Harvey Wiley Interdisciplinary Reviews: Computational Molecular Science 4 (1), 1-14, 2014	237	2014
Scope and challenge of computational methods for studying mechanism and reactivity in homogeneous catalysis JN Harvey, F Himo, F Maseras, L Perrin Acs Catalysis 9 (8), 6803-6813, 2019	224	2019
Accurate modelling of Pd (0)+ PhX oxidative addition kinetics CL McMullin, J Jover, JN Harvey, N Fey Dalton Transactions 39 (45), 10833-10836, 2010	215	2010

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