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Fedwa El-Mellouhi
Fedwa El-Mellouhi
Senior Scientist, Qatar Environment and Energy Research Institute
E-mail confirmado em hbku.edu.qa - Página inicial
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Revealing the role of organic cations in hybrid halide perovskite CH3NH3PbI3
C Motta, F El-Mellouhi, S Kais, N Tabet, F Alharbi, S Sanvito
Nature communications 6 (1), 7026, 2015
6842015
Charge carrier mobility in hybrid halide perovskites
C Motta, F El-Mellouhi, S Sanvito
Scientific reports 5 (1), 12746, 2015
3782015
Kinetic activation-relaxation technique: An off-lattice self-learning kinetic Monte Carlo algorithm
F El-Mellouhi, N Mousseau, LJ Lewis
Physical Review B 78 (15), 153202, 2008
1882008
Tuning the solid electrolyte interphase for selective Li‐and Na‐ion storage in hard carbon
FA Soto, P Yan, MH Engelhard, A Marzouk, C Wang, G Xu, Z Chen, ...
Advanced materials 29 (18), 1606860, 2017
1672017
Kinetic activation-relaxation technique
LK Béland, P Brommer, F El-Mellouhi, JF Joly, N Mousseau
Physical Review E 84 (4), 046704, 2011
1642011
Hydrogen bonding and stability of hybrid organic–inorganic perovskites
F El‐Mellouhi, A Marzouk, ET Bentria, SN Rashkeev, S Kais, FH Alharbi
ChemSusChem 9 (18), 2648-2655, 2016
1252016
Sampling the diffusion paths of a neutral vacancy in silicon with quantum mechanical calculations
F El-Mellouhi, N Mousseau, P Ordejón
Physical Review B 70 (20), 205202, 2004
1182004
Cation effect on hot carrier cooling in halide perovskite materials
ME Madjet, GR Berdiyorov, F El-Mellouhi, FH Alharbi, AV Akimov, S Kais
The journal of physical chemistry letters 8 (18), 4439-4445, 2017
1102017
Understanding ionic diffusion through SEI components for lithium-ion and sodium-ion batteries: Insights from first-principles calculations
FA Soto, A Marzouk, F El-Mellouhi, PB Balbuena
Chemistry of Materials 30 (10), 3315-3322, 2018
1032018
The activation-relaxation technique: Art nouveau and kinetic art
N Mousseau, LK Béland, P Brommer, JF Joly, F El-Mellouhi, ...
Journal of Atomic and Molecular Physics 2012, 2012
872012
Self-vacancies in gallium arsenide: An ab initio calculation
F El-Mellouhi, N Mousseau
Physical Review B 71 (12), 125207, 2005
732005
Structural phase transitions of the metal oxide perovskites SrTiO 3, LaAlO 3, and LaTiO 3 studied with a screened hybrid functional
F El-Mellouhi, EN Brothers, MJ Lucero, IW Bulik, GE Scuseria
Physical Review B 87 (3), 035107, 2013
712013
Role of cations on the electronic transport and optical properties of lead-iodide perovskites
GR Berdiyorov, A Kachmar, F El-Mellouhi, MA Carignano, ...
The Journal of Physical Chemistry C 120 (30), 16259-16270, 2016
662016
Enhancing the carrier thermalization time in organometallic perovskites by halide mixing
MEA Madjet, AV Akimov, F El-Mellouhi, GR Berdiyorov, S Ashhab, ...
Physical Chemistry Chemical Physics 18 (7), 5219-5231, 2016
652016
Chalcogenide materials and derivatives for photovoltaic applications
M Buffiere, DS Dhawale, F El-Mellouhi
Energy Technology 7 (11), 1900819, 2019
562019
Exploring new approaches towards the formability of mixed-ion perovskites by DFT and machine learning
H Park, R Mall, FH Alharbi, S Sanvito, N Tabet, H Bensmail, F El-Mellouhi
Physical Chemistry Chemical Physics 21 (3), 1078-1088, 2019
552019
An efficient descriptor model for designing materials for solar cells
FH Alharbi, SN Rashkeev, F El-Mellouhi, HP Lüthi, N Tabet, S Kais
npj Computational Materials 1 (1), 1-9, 2015
552015
Modeling of the cubic and antiferrodistortive phases of SrTiO 3 with screened hybrid density functional theory
F El-Mellouhi, EN Brothers, MJ Lucero, GE Scuseria
Physical Review B 84 (11), 115122, 2011
552011
Full space device optimization for solar cells
AAB Baloch, SP Aly, MI Hossain, F El-Mellouhi, N Tabet, FH Alharbi
Scientific reports 7 (1), 11984, 2017
542017
Exploring the cation dynamics in lead-bromide hybrid perovskites
C Motta, F El-Mellouhi, S Sanvito
Physical Review B 93 (23), 235412, 2016
512016
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