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ABINIT
ABINIT is an open-source suite of programs for materials science, distributed under the GNU General Public License. ABINIT implements density…
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Related topics
Related topics
13 relations
Bethe–Salpeter equation
DP code
Density functional theory
EXC code
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Papers overview
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2019
2019
Electronic Band Structure of Copper Zinc Tin Sulphide ( Cu 2 ZnSnS 4 )
2019
Corpus ID: 150381311
Cu2ZnSnS4 (CZTS), made entirely of abundant materials, has attracted a great interest due to its potential applications in…
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2017
2017
Effet des corrélations locales sur le couplage électron-phonon dans le LSCO en DFT+DMFT
Julien Groulx
2017
Corpus ID: 103771848
Presented here is a study of the effect of strong electronic correlations on the strength of the electron-phonon coupling using…
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2015
2015
Mb Ab initio refining of quasibreathers in graphane
Lobzenko
2015
Corpus ID: 54892835
2015
2015
A Study Focused on Ab-Initio Study of SrTiO 3 Perovskites
Dubey Gaurav
2015
Corpus ID: 47016695
ABO3-type perovskite crystals are important for numerous technological applications in electro optics, waveguides, laser…
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2013
2013
Notes on ABINIT GBRV PAW ’ s
K. Garrity
2013
Corpus ID: 42223673
Notes on and testing results for the ABINIT PAW versions of the GBRV pseudopotential library.
2013
2013
Electronic Struture and Quantum Effects of Thin Metal Film Systems Based on Silicon Carbide
T. Chiang
2013
Corpus ID: 17951100
Abstract : This proposal is a study of the electronic structure and quantum effects of layer systems based on hexagonal silicon…
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2008
2008
Harnessing the power of modern package management tools for a large Fortran-90-based project: the mutation of ABINIT
Y. Pouillon
,
X. Gonze
2008
Corpus ID: 108736022
ABINIT is a Fortran 90 free software application that allows the atomic-scale simulation of properties of matter, thanks to…
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2007
2007
Transforming the high-performance 3 d-FFT in ABINIT to enable the use of non-blocking collective operations
T. Hoefler
,
G. Zérah
2007
Corpus ID: 18126149
This article describes the implementation of the three-dimensional Fast Fourier Transformation in the application ABINIT and…
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2006
2006
On applying the shell theory to single layer graphitic structures
Z. Tu
,
Z. Ou-Yang
2006
Corpus ID: 137282103
The validity of on applying the shell theory to single layer graphitic structures, such as buckball, single-walled carbon…
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2006
2006
First-Principles Study of C 6 M 2 ( M 1⁄4 B , Al , Mg , Li ) , C 7 B and Related Compounds
K. Kobayashi
,
M. Arai
,
Kazuo Yamamoto
2006
Corpus ID: 62796036
We calculate electronic and lattice dynamics properties of C6M2 (M 1⁄4 B, Al, Mg, Li), C7B, AlC2, MgC2, LiC2 and LiB2 compounds…
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