引用次数
引用: 3,442
H-指数: 22
I10-指数 : 34
出版物: 80
TIGHT BINDING MOLECULAR DYNAMICS STUDY OF THE STRUCTURES AND MELTING OF CLUSTERS OF HCP TRANSITION METALS
C. REY , J. GARCIA-RODEJA , O. DIEGUEZ , L. J. GALLEGO
Proceedings of the Fifth International Workshop on Non-Crystalline Solids 511 -516
1998
Multiple structural transitions driven by spin-phonon couplings in a perovskite oxide
Jorge Iniguez , Claudio Cazorla , Oswaldo Dieguez
arXiv: Materials Science
39
2016
Dielectric properties of correlated oxides: a GGA+U electric-enthalpy approach
Nicola Marzari , Matteo Cococcioni , Paolo Umari , Oswaldo Dieguez
APS
2007
Tungsten Oxide Mediated Quasi-van der Waals Epitaxy of WS2 on Sapphire
Assael Cohen , Pranab K Mohapatra , Simon Hettler , Avinash Patsha
ACS nano 17 ( 6) 5399 -5411
2023
Ferroelectricity in layered bismuth oxide down to 1 nanometer
Qianqian Yang , Jingcong Hu , Yue-Wen Fang , Yueyang Jia
Science 379 ( 6638) 1218 -1224
34
2023
Ultralarge polarization in ferroelectric hafnia-based thin films
Han Wu , Kun Lin , Qinghua Zhang , Qian Yu
arXiv preprint arXiv:2403.11777
2024
Supporting Information: Tungsten oxide mediated quasi-van der Waals epitaxy of WS2on sapphire
Assael Cohen , Pranab K Mohapatra , Simon Hettler , Avinash Patsha
American Chemical Society
2023
Efficient calculation of the mean inner potential of solids using density-functional theory
Oswaldo Dieguez , Avi Auslender , Amit Kohn
APS March Meeting Abstracts 2023 S60. 005 -S60. 005
2023
Flexoelectricity and Ferroelectric Domain Walls: Landau Theory from Density-Functional Theory Calculations
Oswaldo Dieguez , Massimiliano Stengel
APS March Meeting Abstracts 2022 Y70. 004 -Y70. 004
2022
Computational discovery of Bi-based perovskite oxide polymorphs
Oswaldo Dieguez , Akansha Singh , Viveka Singh , Enric Canadell
APS March Meeting Abstracts 2019 V04. 008 -V04. 008
2019
Complex structural behaviors of domain walls revealed from first principles
Jorge Iniguez , Jacek C Wojdel , Oswaldo Dieguez
APS March Meeting Abstracts 2014 L41. 009 -L41. 009
2014
Theoretical study of ferroelectric KNO 3
Oswaldo Dieguez , David Vanderbilt
APS March Meeting Abstracts D20. 008 -D20. 008
2007
Electronic structure: Wide-band, narrow-band, and strongly correlated systems-Nonorthogonal generalized Wannier function pseudopotential plane-wave method
Chris-Kriton Skylaris , Arash A Mostofi , Peter D Haynes , Oswaldo Dieguez
Physical Review-Section B-Condensed Matter 66 ( 3) 35119 -35119
2002
Electronic structure: Wide-band, narrow-band, and strongly correlated systems-Comparison of variational real-space representations of the kinetic energy operator
Chris-Kriton Skylaris , Oswaldo Dieguez , Peter D Haynes , Mike C Payne
Physical Review-Section B-Condensed Matter 66 ( 7) 73103 -73103
2002
Domain Walls in Multiferroics
ZV Gareeva , AK Zvezdin , O Dieguez , J Iniguez
Фазовые переходы, критические и нелинейные явления в конденсированных средах 11 -11
2015
Ferroelectricity and tetragonality in perosvkite ultrathin films
J Junquera , O Dieguez , KM Rabe , Philippe Ghosez
Fundamental Physics of Ferroelectrics
1
2004
Surface physics, low-dimensional systems, and related topics-Density-functional calculations of the structures, binding energies, and magnetic moments of Fe clusters with 2 to 17 atoms
O Dieguez , MMG Alemany , C Rey , Pablo Ordejon
Physical Review-Section B-Condensed Matter 63 ( 20) 205407 -205407
1
2001
Surface physics, low-dimensional systems, and related topics-Ab initio density-functional calculations of the geometries, electronic structures, and magnetic moments of Ni-C clusters
C Rey , MMG Alemany , O Dieguez , LJ Gallego
Physical Review-Section B-Condensed Matter 62 ( 19) 12640 -12643
2000
Inhomogeneous, disordered, and partially ordered systems-Molecular-dynamics study of the dynamic properties of fcc transition and simple metals in the liquid phase using the
MMG Alemany , O Dieguez , C Rey , LJ Gallego
Physical Review-Section B-Condensed Matter 60 ( 13) 9208 -9211
1999
Polymorphism in Bi-based perovskite oxides: a first-principles study
Enric Canadell , Jorge Íñiguez , Akansha Singh , Oswaldo Diéguez
arXiv: Materials Science
13
2018
David Vanderbilt L. J. Gallego Carlos Rey Karin M. Rabe P. Ordejon Javier Junquera Peter D Haynes Miguel Pruneda Eduardo Anglada Varela Daniel Sanchez-Portal Julian D Gale Alberto Garcia Emilio Artacho Jose M. Soler Linxing Zhang Arash Mostofi Jeffrey B. Neaton Silvia Tinte stephane fusil Eric Jacquet