Micael J. T. Oliveira
机构: Max Planck Institute for the Structure and Dynamics of Matter
每年引用次数
引用次数
引用: 8,425
H-指数: 23
I10-指数 : 28
出版物: 34
Recent developments in LIBXC - A comprehensive library of functionals for density functional theory
Susi Lehtola , Conrad Steigemann , Micael J.T. Oliveira , Miguel A.L. Marques
SoftwareX 7 1 -5
340
2018
Generating relativistic pseudo-potentials with explicit incorporation of semi-core states using APE, the Atomic Pseudo-potentials Engine ✩
Micael J.T. Oliveira , Fernando Nogueira
Computer Physics Communications 178 ( 7) 524 -534
160
2008
Libxc: A library of exchange and correlation functionals for density functional theory
Miguel A.L. Marques , Micael J.T. Oliveira , Tobias Burnus
Computer Physics Communications 183 ( 10) 2272 -2281
551
2012
The CECAM electronic structure library and the modular software development paradigm
Emine Küçükbenli , Stefano de Gironcoli , Georg Huhs , Dominic Tildesley
Journal of Chemical Physics 153 ( 2) 024117
2
2020
Time-dependent density-functional theory in massively parallel computer architectures: the octopus project
Xavier Andrade , Joseba Alberdi-Rodriguez , David A Strubbe , Micael J T Oliveira
Journal of Physics: Condensed Matter 24 ( 23) 233202 -233202
192
2012
Spin?orbit effects in the bismuth atom and dimer: tight-binding and density functional theory comparison
Micael J T Oliveira , Xavier Gonze
Journal of Physics B 46 ( 9) 095101
6
2013
Time-dependent density-functional theory of strong-field ionization of atoms by soft x rays
A. Crawford-Uranga , U. De Giovannini , E. Räsänen , M. J. T. Oliveira
Physical Review A 90 ( 3) 033412
34
2014
Octopus, a computational framework for exploring light-driven phenomena and quantum dynamics in extended and finite systems
René Jestädt , Irina V. Lebedeva , Silvio Pipolo , Umberto De Giovannini
Journal of Chemical Physics 152 ( 12) 124119
203
2020
Finite-Size Effects in the Absorption Spectra of a Single-Wall Carbon Nanotube
Jaime Silva , Micael J. T. Oliveira , Senentxu Lanceros-Mendez , Fernando Nogueira
Journal of Physical Chemistry C 120 ( 32) 18268 -18274
5
2016
Computational Benchmarking for Ultrafast Electron Dynamics: Wave Function Methods vs Density Functional Theory
Micael J. T. Oliveira , Benoit Mignolet , Tomasz Kus , Theodoros A. Papadopoulos
Journal of Chemical Theory and Computation 11 ( 5) 2221 -2233
11
2015
Band widths and gaps from the Tran-Blaha functional: Comparison with many-body perturbation theory
David Waroquiers , Aurélien Lherbier , Anna Miglio , Martin Stankovski
Physical Review B 87 ( 7) 075121
69
2013
Toward an All-Around Semilocal Potential for Electronic Exchange
Micael J. T. Oliveira , Esa Räsänen , Stefano Pittalis , Miguel A. L. Marques
Journal of Chemical Theory and Computation 6 ( 12) 3664 -3670
16
2010
Benchmarking the AK13 Exchange Functional: Ionization Potentials and Electron Affinities.
Tiago F. T. Cerqueira , Micael J. T. Oliveira , Miguel A. L. Marques
Journal of Chemical Theory and Computation 10 ( 12) 5625 -5629
14
2014
Modeling van der Waals interactions between proteins and inorganic surfaces from time-dependent density functional theory calculations.
Micael J. T. Oliveira , Silvana Botti , Miguel A. L. Marques
Physical Chemistry Chemical Physics 13 ( 33) 15055 -15061
7
2011
The role of dimensionality on the quenching of spin-orbit effects in the optics of gold nanostructures
Alberto Castro , Miguel A. L. Marques , Aldo H. Romero , Micael J. T. Oliveira
Journal of Chemical Physics 129 ( 14) 144110 -144110
28
2008
A survey of the parallel performance and accuracy of Poisson solvers for electronic structure calculations.
Pablo García-Risueño , Joseba Alberdi-Rodriguez , Micael J. T. Oliveira , Xavier Andrade
Journal of Computational Chemistry 35 ( 6) 427 -444
32
2014
Light-matter interactions within the Ehrenfest–Maxwell–Pauli–Kohn–Sham framework: fundamentals, implementation, and nano-optical applications
René Jestädt , Michael Ruggenthaler , Micael J. T. Oliveira , Angel Rubio
Advances in Physics 68 ( 4) 225 -333
53
2019
Photoabsorption spectra of small cationic xenon clusters from time-dependent density functional theory.
Micael J. T. Oliveira , Fernando Nogueira , Miguel A. L. Marques , Angel Rubio
Journal of Chemical Physics 131 ( 21) 214302 -214302
4
2009
Self-consistent DFT +U method for real-space time-dependent density functional theory calculations
Nicolas Tancogne-Dejean , Micael J. T. Oliveira , Angel Rubio
Physical Review B 96 ( 24) 245133
30
2017
Accuracy of Generalized Gradient Approximation functionals for density functional perturbation theory calculations
Lianhua He , Fang Liu , Geoffroy Hautier , Micael J. T. Oliveira
Physical Review B 89 ( 6) 064305
122
2014