Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems.
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Open source molecular modelingRadiation Damage in XFEL: Case study from the oxygen-evolving complex of Photosystem II.Kohn-Sham approach to quantum electrodynamical density-functional theory: Exact time-dependent effective potentials in real space.Insights into colour-tuning of chlorophyll optical response in green plants.Creating stable Floquet-Weyl semimetals by laser-driving of 3D Dirac materialsEllipticity dependence of high-harmonic generation in solids originating from coupled intraband and interband dynamicsInvestigating the electronic structure of a supported metal nanoparticle: Pd in SiCN.Phonon-driven spin-Floquet magneto-valleytronics in MoS2.Pure Even Harmonic Generation from Oriented CO in Linearly Polarized Laser Fields.Atomic-like high-harmonic generation from two-dimensional materials.Accuracy and computational efficiency of real-time subspace propagation schemes for the time-dependent density functional theory.Magnetic properties with multiwavelets and DFT: the complete basis set limit achieved.Impact of the Electronic Band Structure in High-Harmonic Generation Spectra of Solids.An atomic orbital based real-time time-dependent density functional theory for computing electronic circular dichroism band spectra.Ab Initio Optimized Effective Potentials for Real Molecules in Optical Cavities: Photon Contributions to the Molecular Ground State.VUV photo-processing of PAH cations: quantitative study on the ionization versus fragmentation processes.Efficient and accurate modeling of electron photoemission in nanostructures with TDDFTSelf-consistent DFT+U method for real-space time-dependent density functional theory calculationsAll-optical nonequilibrium pathway to stabilising magnetic Weyl semimetals in pyrochlore iridatesQuantum mechanics in an evolving Hilbert space
P2860
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P2860
Real-space grids and the Octopus code as tools for the development of new simulation approaches for electronic systems.
description
2015 nî lūn-bûn
@nan
2015 թուականի Նոյեմբերին հրատարակուած գիտական յօդուած
@hyw
2015 թվականի նոյեմբերին հրատարակված գիտական հոդված
@hy
2015年の論文
@ja
2015年論文
@yue
2015年論文
@zh-hant
2015年論文
@zh-hk
2015年論文
@zh-mo
2015年論文
@zh-tw
2015年论文
@wuu
name
Real-space grids and the Octop ...... oaches for electronic systems.
@ast
Real-space grids and the Octop ...... oaches for electronic systems.
@en
type
label
Real-space grids and the Octop ...... oaches for electronic systems.
@ast
Real-space grids and the Octop ...... oaches for electronic systems.
@en
altLabel
Real-space grids and the Octop ...... roaches for electronic systems
@en
prefLabel
Real-space grids and the Octop ...... oaches for electronic systems.
@ast
Real-space grids and the Octop ...... oaches for electronic systems.
@en
P2093
P2860
P50
P356
P1476
Real-space grids and the Octop ...... roaches for electronic systems
@en
Real-space grids and the Octop ...... oaches for electronic systems.
@en
P2093
Alejandro Varas
Ask Hjorth Larsen
David Strubbe
P2283
P2860
P304
31371-31396
P356
10.1039/C5CP00351B
P407
P50
P577
2015-02-27T00:00:00Z
2015-11-25T00:00:00Z
P698
P818
1501.05654