Peter E. Blöchl

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Ole Krogh AndersenDirector em. Max Planck Institute for Solid State Research, StuttgartDirección de correo verificada de fkf.mpg.de
Chris G. Van de WalleProfessor of Materials, University of California, Santa BarbaraDirección de correo verificada de mrl.ucsb.edu
Johannes KästnerUniversity of StuttgartDirección de correo verificada de theochem.uni-stuttgart.de
Andrew FisherProfessor of Physics, University College LondonDirección de correo verificada de ucl.ac.uk
michele parrinelloDepartment of ChemistryDirección de correo verificada de phys.chem.ethz.ch
James StathisIBM ResearchDirección de correo verificada de us.ibm.com
Brice ArnaudProfesseur, Université du MansDirección de correo verificada de univ-lemans.fr
sebastien lebegueCNRSDirección de correo verificada de univ-lorraine.fr
KATAN ClaudineCNRS, Institut des sciences chimiques de RennesDirección de correo verificada de univ-rennes1.fr
G A D BriggsProfessor of Nanomaterials, University of OxfordDirección de correo verificada de materials.ox.ac.uk
Walter LambrechtPerkins Professor of Physics, Case Western Reserve UniversityDirección de correo verificada de case.edu
Johannes SarntheinProfessor für Neurophysiologie, UniversitätsSpital ZürichDirección de correo verificada de usz.ch

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Peter E. Blöchl

Professor for Theoretical Physics, Clausthal University of Technology

Dirección de correo verificada de tu-clausthal.de

theoretical physics material science theoretical chemistry condensed matter theory ab-initio simulations


Título Ordenar por citas Ordenar por año Ordenar por título	Citado por Citado por	Año
Projector augmented-wave method PE Blöchl Physical Review B 50 (24), 17953, 1994	71728	1994
Projector augmented-wave method PE Blochl Physical Review-Section B-Condensed Matter 50 (24), 17953-17979, 1994	27598	1994
Improved tetrahedron method for Brillouin-zone integrations PE Blöchl, O Jepsen, OK Andersen Physical Review B 49 (23), 16223, 1994	7652	1994
Crystal orbital Hamilton populations (COHP): energy-resolved visualization of chemical bonding in solids based on density-functional calculations R Dronskowski, PE Blöchl The Journal of Physical Chemistry 97 (33), 8617-8624, 1993	3837	1993
Implementation of the projector augmented-wave LDA+ U method: Application to the electronic structure of NiO O Bengone, M Alouani, P Blöchl, J Hugel Physical Review B 62 (24), 16392, 2000	658	2000
Först, and Johannes Schimpl PE Blöchl, J Clemens Bull. Mater. Sci 26, 33, 2003	645*	2003
First-principles calculations of defects in oxygen-deficient silica exposed to hydrogen PE Blöchl Physical Review B 62 (10), 6158, 2000	461	2000
Adiabaticity in first-principles molecular dynamics PE Blöchl, M Parrinello Physical Review B 45 (16), 9413, 1992	409	1992
Native defects and self-compensation in ZnSe DB Laks, CG Van de Walle, GF Neumark, PE Blöchl, ST Pantelides Physical Review B 45 (19), 10965, 1992	392	1992
Generalized separable potentials for electronic-structure calculations PE Blöchl Physical Review B 41 (8), 5414, 1990	376	1990
The interface between silicon and a high-k oxide CJ Först, CR Ashman, K Schwarz, PE Blöchl Nature 427 (6969), 53-56, 2004	375	2004
Hydrogen electrochemistry and stress-induced leakage current in silica PE Blöchl, JH Stathis Physical review letters 83 (2), 372, 1999	352	1999
First-principles calculations of self-diffusion constants in silicon PE Blöchl, E Smargiassi, R Car, DB Laks, W Andreoni, ST Pantelides Physical review letters 70 (16), 2435, 1993	343	1993
First-principles calculations of hyperfine parameters CG Van de Walle, PE Bloechl Physical Review B 47 (8), 4244, 1993	331	1993
Electrostatic decoupling of periodic images of plane‐wave‐expanded densities and derived atomic point charges PE Blöchl The Journal of chemical physics 103 (17), 7422-7428, 1995	289	1995
Electric-field-gradient calculations using the projector augmented wave method HM Petrilli, PE Blöchl, P Blaha, K Schwarz Physical Review B 57 (23), 14690, 1998	266	1998
Implementation of an all-electron GW approximation based on the projector augmented wave method without plasmon pole approximation: Application to Si, SiC, AlAs, InAs, NaH, and KH S Lebègue, B Arnaud, M Alouani, PE Bloechl Physical Review B 67 (15), 155208, 2003	264	2003
Method and system for prioritization of task items P Bloechl, M Stolze, K Whittingham US Patent App. 10/713,931, 2005	221	2005
Toward an alkene hydroamination catalyst: static and dynamic ab initio DFT studies HM Senn, PE Blöchl, A Togni Journal of the American Chemical Society 122 (17), 4098-4107, 2000	220	2000
Combined Static and Dynamic Density Functional Study of the Ti (IV) Constrained Geometry Catalyst (CpSiH2NH) TiR+. 1. Resting States and Chain Propagation TK Woo, PM Margl, JCW Lohrenz, PE Blöchl, T Ziegler Journal of the American Chemical Society 118 (51), 13021-13030, 1996	184	1996

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