Christopher E. Patrick
Christopher E. Patrick
Department of Materials, University of Oxford
Adresse e-mail validée de materials.ox.ac.uk
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TiO2 Anatase with a Bandgap in the Visible Region
C Dette, MA Pérez-Osorio, CS Kley, P Punke, CE Patrick, P Jacobson, ...
Nano letters 14 (11), 6533-6538, 2014
4042014
G W quasiparticle band structures of stibnite, antimonselite, bismuthinite, and guanajuatite
MR Filip, CE Patrick, F Giustino
Physical Review B 87 (20), 205125, 2013
1492013
Structural and electronic properties of semiconductor‐sensitized solar‐cell interfaces
CE Patrick, F Giustino
Advanced Functional Materials 21 (24), 4663-4667, 2011
1212011
Quantum nuclear dynamics in the photophysics of diamondoids
CE Patrick, F Giustino
Nature communications 4 (1), 1-7, 2013
852013
GW quasiparticle bandgaps of anatase TiO2 starting from DFT+ U
CE Patrick, F Giustino
Journal of Physics: Condensed Matter 24 (20), 202201, 2012
832012
Atomic-Scale Observation of Multiconformational Binding and Energy Level Alignment of Ruthenium-Based Photosensitizers on TiO2 Anatase
CS Kley, C Dette, G Rinke, CE Patrick, J Čechal, SJ Jung, M Baur, ...
Nano letters 14 (2), 563-569, 2014
702014
Anharmonic stabilization and band gap renormalization in the perovskite CsSnI 3
CE Patrick, KW Jacobsen, KS Thygesen
Physical Review B 92 (20), 201205, 2015
572015
Stochastic approach to phonon-assisted optical absorption
M Zacharias, CE Patrick, F Giustino
Physical review letters 115 (17), 177401, 2015
562015
Adiabatic-connection fluctuation-dissipation DFT for the structural properties of solids—The renormalized ALDA and electron gas kernels
CE Patrick, KS Thygesen
The Journal of chemical physics 143 (10), 102802, 2015
512015
Unified theory of electron–phonon renormalization and phonon-assisted optical absorption
CE Patrick, F Giustino
Journal of Physics: Condensed Matter 26 (36), 365503, 2014
502014
Structure of a Water Monolayer on the Anatase Surface
CE Patrick, F Giustino
Physical Review Applied 2 (1), 014001, 2014
362014
Rare-earth/transition-metal magnetic interactions in pristine and (Ni,Fe)-doped and
JBS CE Patrick, S. Kumar, G. Balakrishnan, RS Edwards, MR Lees, E. Mendive ...
Phys. Rev. Mater. 1, 024411, 2017
30*2017
Simple vertex correction improves band energies of bulk and two-dimensional crystals
PS Schmidt, CE Patrick, KS Thygesen
Physical Review B 96 (20), 205206, 2017
292017
Rare-earth/transition-metal magnets at finite temperature: Self-interaction-corrected relativistic density functional theory in the disordered local moment picture
CE Patrick, JB Staunton
Physical Review B 97 (22), 224415, 2018
262018
Calculating the magnetic anisotropy of rare-earth–transition-metal ferrimagnets
CE Patrick, S Kumar, G Balakrishnan, RS Edwards, MR Lees, L Petit, ...
Physical review letters 120 (9), 097202, 2018
262018
O 1 s core-level shifts at the anatase TiO 2 (101)/N3 photovoltaic interface: Signature of H-bonded supramolecular assembly
CE Patrick, F Giustino
Physical Review B 84 (8), 085330, 2011
262011
Quantitative analysis of valence photoemission spectra and quasiparticle excitations at chromophore-semiconductor interfaces
CE Patrick, F Giustino
Physical review letters 109 (11), 116801, 2012
232012
corrected Hamiltonians for non-self-consistent random-phase approximation total-energy calculations: A study of ZnS, , and NiO
CE Patrick, KS Thygesen
Physical Review B 93 (3), 035133, 2016
202016
Temperature-dependent magnetocrystalline anisotropy of rare earth/transition metal permanent magnets from first principles: The light R Co 5 (R= Y, La-Gd) intermetallics
CE Patrick, JB Staunton
Physical Review Materials 3 (10), 101401, 2019
172019
Crystal field coefficients for yttrium analogues of rare-earth/transition-metal magnets using density-functional theory in the projector-augmented wave formalism
CE Patrick, JB Staunton
Journal of Physics: Condensed Matter 31 (30), 305901, 2019
112019
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