David Vanderbilt

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Karin M. RabeProfessor of Physics, Rutgers UniversityVerified email at physics.rutgers.edu
Nicola MarzariChair of Theory and Simulation of Materials, École Polytechnique Fédérale de Lausanne (EPFL)Verified email at epfl.ch
Jonathan YatesDepartment of Materials, University of OxfordVerified email at materials.ox.ac.uk
Kristjan HauleDistinguished Professor of Physics, Rutgers UniversityVerified email at physics.rutgers.edu
Xifan WuProfessor of Physics, Temple UniversityVerified email at temple.edu
Vincenzo FiorentiniAssociate professor of condensed matter physics, University of Cagliari, ItalyVerified email at dsf.unica.it
Ricardo Wagner NunesDepartamento de Física - Universidade Federal de Minas GeraisVerified email at fisica.ufmg.br
Roberto CarRalph W Dornte Professor in Chemistry, Princeton University Verified email at princeton.edu
Jeffrey B. NeatonUniversity of California, Berkeley & Lawrence Berkeley National LaboratoryVerified email at lbl.gov
Jorge ÍñiguezLuxembourg Institute of Science and Technology (LIST)Verified email at list.lu
Steven G. LouieProfessor of Physics, University of California at BerkeleyVerified email at berkeley.edu
Kevin F. GarrityResearch Physicist, NISTVerified email at nist.gov
Andrei MalashevichPostdoc in Applied Physics, Yale UniversityVerified email at yale.edu
Sinisa CohUniversity of California, RiversideVerified email at ucr.edu
Alberto GarciaInstitut de Ciencia de Materials de Barcelona (ICMAB-CSIC)Verified email at icmab.es
Davide CeresoliCNR-SCITECVerified email at cnr.it
Massimiliano StengelICREA and ICMAB-CSICVerified email at icmab.es
Arash MostofiDepartments of Materials and Physics, Imperial College LondonVerified email at imperial.ac.uk
Raffaele Restatrieste or pisa or purdue or lausanneVerified email at democritos.it
Oswaldo DieguezTel Aviv UniversityVerified email at post.tau.ac.il

David Vanderbilt

Professor of Physics and Astronomy, Rutgers University

Verified email at physics.rutgers.edu - Homepage

Condensed matter theory Materials theory Condensed matter physics Materials physics


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Soft self-consistent pseudopotentials in a generalized eigenvalue formalism D Vanderbilt Physical review B 41 (11), 7892, 1990	22306	1990
Maximally localized generalized Wannier functions for composite energy bands N Marzari, D Vanderbilt Physical review B 56 (20), 12847, 1997	3553	1997
Spontaneous polarization and piezoelectric constants of III-V nitrides F Bernardini, V Fiorentini, D Vanderbilt Physical Review B 56 (16), R10024, 1997	3376	1997
Theory of polarization of crystalline solids RD King-Smith, D Vanderbilt Physical Review B 47 (3), 1651, 1993	3273	1993
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	2384	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, 2012	1679	2012
Maximally localized Wannier functions for entangled energy bands I Souza, N Marzari, D Vanderbilt Physical Review B 65 (3), 035109, 2001	1481	2001
Car-Parrinello molecular dynamics with Vanderbilt ultrasoft pseudopotentials K Laasonen, A Pasquarello, R Car, C Lee, D Vanderbilt Physical Review B 47 (16), 10142, 1993	1449	1993
Electric polarization as a bulk quantity and its relation to surface charge D Vanderbilt, RD King-Smith Physical Review B 48 (7), 4442, 1993	1035	1993
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	939	2014
Giant LO-TO splittings in perovskite ferroelectrics W Zhong, RD King-Smith, D Vanderbilt Physical review letters 72 (22), 3618, 1994	887	1994
Optimally smooth norm-conserving pseudopotentials D Vanderbilt Physical Review B 32 (12), 8412, 1985	853	1985
Thermal contraction and disordering of the Al (110) surface N Marzari, D Vanderbilt, A De Vita, MC Payne Physical review letters 82 (16), 3296, 1999	847	1999
Density-matrix electronic-structure method with linear system-size scaling XP Li, RW Nunes, D Vanderbilt Physical Review B 47 (16), 10891, 1993	814	1993
First-principles investigation of ferroelectricity in perovskite compounds RD King-Smith, D Vanderbilt Physical Review B 49 (9), 5828, 1994	786	1994
Magnetoelectric polarizability and axion electrodynamics in crystalline insulators AM Essin, JE Moore, D Vanderbilt Physical review letters 102 (14), 146805, 2009	782	2009
Pseudopotentials for high-throughput DFT calculations KF Garrity, JW Bennett, KM Rabe, D Vanderbilt Computational Materials Science 81, 446-452, 2014	759	2014
First-principles study of structural, vibrational, and lattice dielectric properties of hafnium oxide X Zhao, D Vanderbilt Physical Review B 65 (23), 233106, 2002	757	2002
First-principles theory of ferroelectric phase transitions for perovskites: The case of W Zhong, D Vanderbilt, KM Rabe Physical Review B 52 (9), 6301, 1995	742	1995
Spontaneous formation of stress domains on crystal surfaces OL Alerhand, D Vanderbilt, RD Meade, JD Joannopoulos Physical review letters 61 (17), 1973, 1988	740	1988

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