Jonathan Yates

Citata da

	Tutte	Dal 2019
Citazioni	20382	12726
Indice H	44	31
i10-index	76	58

2800

1400

700

2100

200620072008200920102011201220132014201520162017201820192020202120222023202460 128 130 214 321 354 522 611 654 751 1012 1319 1441 1629 1820 1925 2175 2469 2703

Accesso pubblico

Visualizza tutto

35 articoli

2 articoli

Disponibili

Non disponibili

In base ai mandati di finanziamento

Coautori

Chris J. PickardSir Alan Cottrell Professor of Materials Science, University of CambridgeEmail verificata su cam.ac.uk
David VanderbiltProfessor of Physics and Astronomy, Rutgers UniversityEmail verificata su physics.rutgers.edu
Nicola MarzariÉcole Polytechnique Fédérale de Lausanne (EPFL), and Paul Scherrer Institut (PSI)Email verificata su epfl.ch
Francesco MauriSapienza Università di RomaEmail verificata su uniroma1.it
Arash MostofiDepartments of Materials and Physics, Imperial College LondonEmail verificata su imperial.ac.uk
R J NichollsDepartment of Materials, University of OxfordEmail verificata su materials.ox.ac.uk
Giovanni PizziLaboratory for Materials Simulations, Paul Scherrer Institute (PSI), Villigen PSI, SwitzerlandEmail verificata su psi.ch
Keith RefsonISIS Facility, Science and Technology Facilities Council, Harwell Campus, Chilton, Didcot, Oxon OX11Email verificata su stfc.ac.uk
Sharon E AshbrookProfessor of Chemistry, University of St AndrewsEmail verificata su st-andrews.ac.uk
John M GriffinLancaster UniversityEmail verificata su lancaster.ac.uk
Paul HodgkinsonDurham UniversityEmail verificata su durham.ac.uk
Dominique MassiotDirecteur de Recherche CNRS - CEMHTI CNRS UPR3079 - OrléansEmail verificata su cnrs-orleans.fr
Peter NellistProfessor of Materials, University of OxfordEmail verificata su materials.ox.ac.uk
Tim GreenGoogle DeepMindEmail verificata su google.com
christian BONHOMMEprofesseur de chimie, Université Pierre et Marie CurieEmail verificata su upmc.fr
Albert P. BartokUniversity of WarwickEmail verificata su warwick.ac.uk
Stewart ClarkProfessor of Physics, University of DurhamEmail verificata su durham.ac.uk
Matt ProbertUniversity of YorkEmail verificata su york.ac.uk
Phil HasnipUniversity of YorkEmail verificata su york.ac.uk
Andrew James MorrisUniversity of BirminghamEmail verificata su bham.ac.uk

Segui

Jonathan Yates

Department of Materials, University of Oxford

Email verificata su materials.ox.ac.uk - Home page

Computational Materials Science solid-state NMR EELS


Titolo Ordina per citazioni Ordina per anno Ordina per titolo	Citata da Citata da	Anno
wannier90: A tool for obtaining maximally-localised Wannier functions AA Mostofi, JR Yates, YS Lee, I Souza, D Vanderbilt, N Marzari Computer physics communications 178 (9), 685-699, 2008	3969	2008
Maximally localized Wannier functions: Theory and applications N Marzari, AA Mostofi, JR Yates, I Souza, D Vanderbilt Reviews of Modern Physics 84 (4), 1419-1475, 2012	3200	2012
An updated version of wannier90: A tool for obtaining maximally-localised Wannier functions AA Mostofi, JR Yates, G Pizzi, YS Lee, I Souza, D Vanderbilt, N Marzari Computer Physics Communications 185 (8), 2309-2310, 2014	2140	2014
Wannier90 as a community code: new features and applications G Pizzi, V Vitale, R Arita, S Blügel, F Freimuth, G Géranton, M Gibertini, ... Journal of Physics: Condensed Matter 32 (16), 165902, 2020	1493	2020
Reproducibility in density functional theory calculations of solids K Lejaeghere, G Bihlmayer, T Björkman, P Blaha, S Blügel, V Blum, ... Science 351 (6280), aad3000, 2016	1493*	2016
Calculation of NMR chemical shifts for extended systems using ultrasoft pseudopotentials JR Yates, CJ Pickard, F Mauri Physical Review B 76 (2), 024401, 2007	1039	2007
Ab initio calculation of the anomalous Hall conductivity by Wannier interpolation X Wang, JR Yates, I Souza, D Vanderbilt Physical Review B 74 (19), 195118, 2006	607	2006
First-Principles Calculation of NMR Parameters Using the Gauge Including Projector Augmented Wave Method: A Chemist’s Point of View C Bonhomme, C Gervais, F Babonneau, C Coelho, F Pourpoint, T Azaïs, ... Chemical Reviews 112 (11), 5733-5779, 2012	555	2012
Density functional theory in the solid state PJ Hasnip, K Refson, MIJ Probert, JR Yates, SJ Clark, CJ Pickard Philosophical Transactions of the Royal Society A: Mathematical, Physical …, 2014	466	2014
Spectral and Fermi surface properties from Wannier interpolation JR Yates, X Wang, D Vanderbilt, I Souza Physical Review B 75 (19), 195121, 2007	360	2007
Electron and vibrational spectroscopies using DFT, plane waves and pseudopotentials: CASTEP implementation V Milman, K Refson, SJ Clark, CJ Pickard, JR Yates, SP Gao, PJ Hasnip, ... Journal of Molecular Structure: THEOCHEM 954 (1-3), 22-35, 2010	294	2010
Chemical shift computations on a crystallographic basis: some reflections and comments RK Harris, P Hodgkinson, CJ Pickard, JR Yates, V Zorin Magnetic Resonance in Chemistry 45 (S1), S174-S186, 2007	249	2007
An Investigation of Weak CH⊙⊙⊙ O Hydrogen Bonds in Maltose Anomers by a Combination of Calculation and Experimental Solid-State NMR Spectroscopy JR Yates, TN Pham, CJ Pickard, F Mauri, AM Amado, AM Gil, SP Brown Journal of the American Chemical Society 127 (29), 10216-10220, 2005	225	2005
Regularized SCAN functional AP Bartók, JR Yates The Journal of chemical physics 150 (16), 2019	224	2019
Fermi-surface calculation of the anomalous Hall conductivity X Wang, D Vanderbilt, JR Yates, I Souza Physical Review B 76 (19), 195109, 2007	185	2007
OptaDOS: A tool for obtaining density of states, core-level and optical spectra from electronic structure codes AJ Morris, RJ Nicholls, CJ Pickard, JR Yates Computer Physics Communications 185 (5), 1477-1485, 2014	180	2014
Electron-phonon interaction via electronic and lattice Wannier functions: superconductivity in boron-doped diamond reexamined F Giustino, JR Yates, I Souza, ML Cohen, SG Louie Physical review letters 98 (4), 47005, 2007	175	2007
A combined first principles computational and solid-state NMR study of a molecular crystal: flurbiprofen JR Yates, SE Dobbins, CJ Pickard, F Mauri, PY Ghi, RK Harris Physical Chemistry Chemical Physics 7 (7), 1402-1407, 2005	168	2005
Structural studies of the polymorphs of carbamazepine, its dihydrate, and two solvates RK Harris, PY Ghi, H Puschmann, DC Apperley, UJ Griesser, ... Organic process research & development 9 (6), 902-910, 2005	162	2005
Nanoscale momentum-resolved vibrational spectroscopy FS Hage, RJ Nicholls, JR Yates, DG McCulloch, TC Lovejoy, N Dellby, ... Science Advances 4 (6), eaar7495, 2018	155	2018

Il sistema al momento non può eseguire l'operazione. Riprova più tardi.

Articoli 1–20

Citazioni per anno

Citazioni duplicate

Citazioni unite

Aggiungi coautoriCoautori

Segui

Citata da

Coautori