R. W. Nunes

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All published works

Action	Title	Year	Authors
+ PDF Chat	Group-IV Pentaoctite: A New 2D Material Family	2024	Vanessa D. Kegler I. S. Santos de Oliveira Dominike Pacine de Andrade Deus R. W. Nunes T. A. S. Pereira Erika N. Lima
+ PDF Chat	Magnetic states of linear defects in graphene monolayers: Effects of strain and interaction	2017	Simone S. Alexandre R. W. Nunes
+ PDF Chat	Topologically Protected Metallic States Induced by a One-Dimensional Extended Defect in the Bulk of a 2D Topological Insulator	2016	Erika N. Lima T. M. Schmidt R. W. Nunes
+	Theoretical chemistry of $\alpha$-graphyne: functionalization, symmetry breaking, and generation of Dirac-fermion mass	2014	R. Longuinhos Elie A. Moujaes Simone S. Alexandre R. W. Nunes
+	Theoretical chemistry of $α$-graphyne: functionalization, symmetry breaking, and generation of Dirac-fermion mass	2014	R. Longuinhos Elie A. Moujaes Simone S. Alexandre R. W. Nunes
+ PDF Chat	Non-hexagonal-ring defects and structures induced by healing and strain in graphene and functionalized graphene	2012	Joice da Silva-Araújo A J M Nascimento H. Chacham R. W. Nunes
+	Stability of extended defects on boron nitride and graphene monolayers: the role of chemical environment	2012	Lídia Gomes Simone S. Alexandre H. Chacham R. W. Nunes
+	Correlated magnetic states in domain and grain boundaries in graphene	2011	Simone S. Alexandre A. D. Lúcio A. H. Castro Neto R. W. Nunes
+ PDF Chat	A study of inner process double-resonance Raman scattering in bilayer graphene	2010	D. L. Mafra Elie A. Moujaes Stephen K. Doorn Han Htoon R. W. Nunes M. A. Pimenta
+ PDF Chat	Gap opening in topological-defect lattices in graphene	2010	Joice da Silva-Araújo H. Chacham R. W. Nunes
+ PDF Chat	Bistability, softening, and quenching of magnetic moments in Ni-filled carbon nanotubes	2010	Eduardo Moraes Diniz R. W. Nunes H. Chacham Mário S. C. Mazzoni
+ PDF Chat	Complex evolution of the electronic structure from polycrystalline to monocrystalline graphene: Generation of a new Dirac point	2010	Joice da Silva Araújo R. W. Nunes
+ PDF Chat	DNA-psoralen: Single-molecule experiments and first principles calculations	2009	M. S. Rocha A. D. Lúcio Simone S. Alexandre R. W. Nunes O. N. Mesquita
+ PDF Chat	Semiconducting chains of gold and silver	2007	Frederico Fioravante R. W. Nunes
+ PDF Chat	Surface Dangling-Bond States and Band Lineups in Hydrogen-Terminated Si, Ge, and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>Ge</mml:mi><mml:mo>/</mml:mo><mml:mi>Si</mml:mi></mml:math>Nanowires	2007	R. Kagimura R. W. Nunes H. Chacham
+ PDF Chat	Structures of Si and Ge Nanowires in the Subnanometer Range	2005	R. Kagimura R. W. Nunes H. Chacham
+ PDF Chat	Stacking-Fault Based Microscopic Model for Platelets in Diamond	2004	Caetano R. Miranda Alex Antonelli R. W. Nunes
+ PDF Chat	Stability of antiphase line defects in nanometer-sized boron nitride cones	2004	S. Azevedo Mário S. C. Mazzoni R. W. Nunes H. Chacham
+	Electronic structure of nanocones of boron nitrite	2004	S. Azevedo Mário S. C. Mazzoni H. Chacham R. W. Nunes
+ PDF Chat	Temperature effects on dislocation core energies in silicon and germanium	2003	Caetano R. Miranda R. W. Nunes Alex Antonelli
+ PDF Chat	Berry-phase treatment of the homogeneous electric field perturbation in insulators	2001	R. W. Nunes Xavier Gonze
+ PDF Chat	Models of core reconstruction for the 90° partial dislocation in semiconductors	2000	R. W. Nunes David Vanderbilt
+ PDF Chat	Stability of the Period-Doubled Core of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>Partial in Silicon	2000	R. W. Nunes David Vanderbilt
+ PDF Chat	Theoretical search for Chevrel-phase-based thermoelectric materials	1999	R. W. Nunes I. I. Mazin David J. Singh
+ PDF Chat	Core reconstruction of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>partial dislocation in nonpolar semiconductors	1998	R. W. Nunes J. Bennetto David Vanderbilt
+ PDF Chat	Atomic structure of dislocation kinks in silicon	1998	R. W. Nunes J. Bennetto David Vanderbilt
+ PDF Chat	Period-Doubled Structure for the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>Partial Dislocation in Silicon	1997	J. Bennetto R. W. Nunes David Vanderbilt
+ PDF Chat	Structure, Barriers, and Relaxation Mechanisms of Kinks in the 90° Partial Dislocation in Silicon	1996	R. W. Nunes J. Bennetto David Vanderbilt
+ PDF Chat	Generalization of the density-matrix method to a nonorthogonal basis	1994	R. W. Nunes David Vanderbilt
+ PDF Chat	Real-Space Approach to Calculation of Electric Polarization and Dielectric Constants	1994	R. W. Nunes David Vanderbilt

Common Coauthors

Coauthor	Papers Together
H. Chacham	8
David Vanderbilt	8
Simone S. Alexandre	6
J. Bennetto	4
Mário S. C. Mazzoni	3
Elie A. Moujaes	3
Caetano R. Miranda	2
Erika N. Lima	2
S. Azevedo	2
R. Longuinhos	2
Alex Antonelli	2
R. Kagimura	2
A. D. Lúcio	2
Joice da Silva-Araújo	2
Joice da Silva Araújo	1
Han Htoon	1
Xavier Gonze	1
Eduardo Moraes Diniz	1
D. L. Mafra	1
T. M. Schmidt	1
Vanessa D. Kegler	1
A. H. Castro Neto	1
Dominike Pacine de Andrade Deus	1
M. A. Pimenta	1
David J. Singh	1
Lídia Gomes	1
I. I. Mazin	1
Stephen K. Doorn	1
T. A. S. Pereira	1
Frederico Fioravante	1
I. S. Santos de Oliveira	1
O. N. Mesquita	1
M. S. Rocha	1
A J M Nascimento	1

Commonly Cited References

Action	Title	Year	Authors	# of times referenced
+ PDF Chat	The SIESTA method for<i>ab initio</i>order-<i>N</i>materials simulation	2002	José M. Soler Emilio Artacho Julian D. Gale Alberto Garcı́a Javier Junquera Pablo Ordejón Daniel Sánchez‐Portal	10
+ PDF Chat	Structure, Barriers, and Relaxation Mechanisms of Kinks in the 90° Partial Dislocation in Silicon	1996	R. W. Nunes J. Bennetto David Vanderbilt	5
+ PDF Chat	Period-Doubled Structure for the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>Partial Dislocation in Silicon	1997	J. Bennetto R. W. Nunes David Vanderbilt	5
+ PDF Chat	The electronic properties of graphene	2009	A. H. Castro Neto F. Guinea N. M. R. Peres Kostya S. Novoselov A. K. Geǐm	5
+ PDF Chat	Self-consistent order-<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>N</mml:mi></mml:math>density-functional calculations for very large systems	1996	Pablo Ordejón Emilio Artacho José M. Soler	4
+ PDF Chat	Electric Field Effect in Atomically Thin Carbon Films	2004	Kostya S. Novoselov A. K. Geǐm С. В. Морозов Da Jiang Y. Zhang S. V. Dubonos I. V. Grigorieva А. А. Firsov	3
+ PDF Chat	Chiral tunnelling and the Klein paradox in graphene	2006	M. I. Katsnelson Kostya S. Novoselov A. K. Geǐm	3
+ PDF Chat	Gap opening in topological-defect lattices in graphene	2010	Joice da Silva-Araújo H. Chacham R. W. Nunes	2
+ PDF Chat	Nonlinear Elasticity of Monolayer Graphene	2009	Emiliano Cadelano Pier Luca Palla Stefano Giordano Luciano Colombo	2
+ PDF Chat	Structural and electronic properties of grain boundaries in graphite: Planes of periodically distributed point defects	2009	Jiří Červenka C. F. J. Flipse	2
+	Effects of topological defects and local curvature on the electronic properties of planar graphene	2006	Alberto Cortijo María A. H. Vozmediano	2
+ PDF Chat	Controlled growth of a line defect in graphene and implications for gate-tunable valley filtering	2014	Jianhao Chen G. Autès Nasim Alem Fernando Gargiulo Abhay Raj Singh Gautam Martin Linck Christian Kisielowski Oleg V. Yazyev Steven G. Louie Alex Zettl	2
+ PDF Chat	From Point Defects in Graphene to Two-Dimensional Amorphous Carbon	2011	Jani Kotakoski Arkady V. Krasheninnikov Ute Kaiser Jannik C. Meyer	2
+ PDF Chat	Stability of the Period-Doubled Core of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>Partial in Silicon	2000	R. W. Nunes David Vanderbilt	2
+ PDF Chat	Core reconstruction of the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mn>90</mml:mn><mml:mi>°</mml:mi></mml:math>partial dislocation in nonpolar semiconductors	1998	R. W. Nunes J. Bennetto David Vanderbilt	2
+ PDF Chat	New Generation of Massless Dirac Fermions in Graphene under External Periodic Potentials	2008	Cheol-Hwan Park Li Yang Young‐Woo Son Marvin L. Cohen Steven G. Louie	2
+ PDF Chat	Strain Engineering of Graphene’s Electronic Structure	2009	Vitor M. Pereira A. H. Castro Neto	2
+ PDF Chat	Complex evolution of the electronic structure from polycrystalline to monocrystalline graphene: Generation of a new Dirac point	2010	Joice da Silva Araújo R. W. Nunes	2
+ PDF Chat	Projector augmented-wave method	1994	Peter E. Blöchl	1
+ PDF Chat	Gate-induced insulating state in bilayer graphene devices	2007	Jeroen B. Oostinga H. B. Heersche Xinglan Liu Alberto F. Morpurgo L. M. K. Vandersypen	1
+ PDF Chat	Substrate-induced band gap in graphene on hexagonal boron nitride:<i>Ab initio</i>density functional calculations	2007	Gianluca Giovannetti Petr A. Khomyakov Geert Brocks Paul J. Kelly Jeroen van den Brink	1
+ PDF Chat	Long-wavelength behavior of the exchange-correlation kernel in the Kohn-Sham theory of periodic systems	1997	Philippe Ghosez Xavier Gonze R. W. Godby	1
+ PDF Chat	Probing the electronic structure of bilayer graphene by Raman scattering	2007	Leandro M. Malard Johan Nilsson D. C. Elias J. C. Brant F. Plentz E. S. Alves A. H. Castro Neto M. A. Pimenta	1
+ PDF Chat	Density-Polarization Functional Theory of the Response of a Periodic Insulating Solid to an Electric Field	1995	Xavier Gonze Philippe Ghosez R. W. Godby	1
+ PDF Chat	Trigonal warping and Berry’s phase<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mi>N</mml:mi><mml:mi>π</mml:mi></mml:mrow></mml:math>in ABC-stacked multilayer graphene	2009	Mikito Koshino Edward McCann	1
+ PDF Chat	Magnetism of two-dimensional defects in Pd: Stacking faults, twin boundaries, and surfaces	2006	Simone S. Alexandre Eduardo Anglada José M. Soler Félix Ynduráin	1
+ PDF Chat	Defect-induced magnetism in graphene	2007	Oleg V. Yazyev Lothar Helm	1
+ PDF Chat	Uniaxial phase transition in Si:<i>Ab initio</i>calculations	2003	C. C. Cheng	1
+ PDF Chat	Magnetism in Atomic-Size Palladium Contacts and Nanowires	2004	Anna Delin Erio Tosatti Ruben Weht	1
+ PDF Chat	Role of structural evolution in the quantum conductance behavior of gold nanowires during stretching	2003	Luís G. C. Rego Alexandre Reily Rocha Varlei Rodrigues D. Ugarte	1
+ PDF Chat	Gate Tunable Infrared Phonon Anomalies in Bilayer Graphene	2009	Alexey B. Kuzmenko Lara Benfatto E. Cappelluti Iris Crassee D. van der Marel Peter Blake Kostya S. Novoselov A. K. Geǐm	1
+	Nonlinear Functional Analysis and its Applications	1990	Eberhard Zeidler	1
+ PDF Chat	Insulator to Semimetal Transition in Graphene Oxide	2009	Goki Eda Cecilia Mattevi Hisato Yamaguchi HoKwon Kim Manish Chhowalla	1
+ PDF Chat	Computing topological invariants without inversion symmetry	2011	Alexey A. Soluyanov David Vanderbilt	1
+	One-dimensional hole gas in germanium/silicon nanowire heterostructures	2005	Wei Lü Jie Xiang Brian P. Timko Yue Wu Charles M. Lieber	1
+	Rippling of graphene	2009	Rebecca Thompson-Flagg M. J. B. Moura Michael Marder	1
+ PDF Chat	Structures of Si and Ge Nanowires in the Subnanometer Range	2005	R. Kagimura R. W. Nunes H. Chacham	1
+ PDF Chat	Universal Probes of Two-Dimensional Topological Insulators: Dislocation and<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mi>π</mml:mi></mml:math>Flux	2012	Vladimir Juričić Andrej Mesaroš Robert-Jan Slager Jan Zaanen	1
+ PDF Chat	Electronic-structure calculations and molecular-dynamics simulations with linear system-size scaling	1994	Francesco Mauri Giulia Galli	1
+ PDF Chat	Rotational disorder in few-layer graphene films on<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" display="inline"><mml:mrow><mml:mn>6</mml:mn><mml:mi>H</mml:mi><mml:mtext>−</mml:mtext><mml:mi mathvariant="normal">Si</mml:mi><mml:mi mathvariant="normal">C</mml:mi><mml:mrow><mml:mo>(</mml:mo><mml:mn>000</mml:mn><mml:mtext>−</mml:mtext><mml:mn>1</mml:mn><mml:mo>)</mml:mo></mml:mrow></mml:mrow></mml:math>: A scanning tunneling microscopy study	2008	F. Varchon Pierre Mallet Laurence Magaud J.‐Y. Veuillen	1
+ PDF Chat	Density-Functional Theory of Polar Insulators	1997	Xavier Gonze Philippe Ghosez R. W. Godby	1
+ PDF Chat	Inverse Spin-Galvanic Effect in the Interface between a Topological Insulator and a Ferromagnet	2010	Ion Garate Marcel Franz	1
+ PDF Chat	Tight-binding description of the quasiparticle dispersion of graphite and few-layer graphene	2008	A. Grüneis Claudio Attaccalite Ludger Wirtz Hidetsugu Shiozawa Riichiro Saito Thomas Pichler Ángel Rubio	1
+ PDF Chat	Graphene Valley Filter Using a Line Defect	2011	Daniel Gunlycke C. T. White	1
+ PDF Chat	Electronic states and Landau levels in graphene stacks	2006	F. Guinea A. H. Castro Neto N. M. R. Peres	1
+ PDF Chat	<i>Ab initio</i>theory of gate induced gaps in graphene bilayers	2007	Hongki Min Bhagawan Sahu Sanjay K. Banerjee A. H. MacDonald	1
+ PDF Chat	<i>Ab initio</i>study of gap opening and screening effects in gated bilayer graphene	2009	Paola Gava Michele Lazzeri A. Marco Saitta Francesco Mauri	1
+ PDF Chat	Quantum Spin Hall Effect in Graphene	2005	C. L. Kane E. J. Melé	1
+ PDF Chat	Quantum conductance in silver nanowires: Correlation between atomic structure and transport properties	2002	Varlei Rodrigues Jefferson Bettini Alexandre Reily Rocha Luís G. C. Rego D. Ugarte	1
+ PDF Chat	Real-Space Approach to Calculation of Electric Polarization and Dielectric Constants	1994	R. W. Nunes David Vanderbilt	1