S. Lebègue
发表
T. Bučko,
S. Lebègue,
J. Hafner,
2013
.
S. Lebègue,
B. Arnaud,
M. Alouani,
2003,
cond-mat/0301320.
S. Lebègue,
M. Saubanère,
M. Ben Yahia,
2014,
Nature Communications.
J. Perdew,
A. Ruzsinszky,
G. Csonka,
2009,
0903.4037.
S. Lebègue,
M. Katsnelson,
O. Eriksson,
2009,
0903.0310.
Jürgen Hafner,
Sébastien Lebègue,
Tomáš Bučko,
2010,
The journal of physical chemistry. A.
S. Lebègue,
T. Gould,
M. Badawi,
2019,
Physical Review Materials.
Hyung-Kyu Lim,
Yun Jeong Hwang,
Eok Kyun Lee,
2018
.
S. Lebègue,
2007
.
S. Lebègue,
T. Gould,
D. Rocca,
2020,
Physical chemistry chemical physics : PCCP.
S. Lebègue,
G. Vaitheeswaran,
S. Appalakondaiah,
2015,
The journal of physical chemistry. A.
S. Lebègue,
M. Debbichi,
L. Debbichi,
2019,
Physics Letters A.
S. Lebègue,
B. Malaman,
M. François,
2014,
Inorganic chemistry.
S. Lebègue,
T. Hyeon,
Sunghak Park,
2021,
Energy & Environmental Science.
S. Lebègue,
R. Ahuja,
T. Kang,
2011
.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2010
.
S. Lebègue,
D. Rocca,
B. Herzog,
2022,
Journal of chemical theory and computation.
S. Lebègue,
B. Arnaud,
M. Alouani,
2008
.
S. Lebègue,
O. Eriksson,
B. Sanyal,
2009,
Journal of physics. Condensed matter : an Institute of Physics journal.
S. Lebègue,
Hyungjun Kim,
Stefan Ringe,
2022,
The journal of physical chemistry letters.
S. Lebègue,
B. Arnaud,
M. Alouani,
2005,
Physical review letters.
S. Lebègue,
R. Ahuja,
R. Scheicher,
2009
.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2009
.
S. Lebègue,
M. Luyckx,
B. Wallaert,
1994,
Fundamental & clinical pharmacology.
S. Lebègue,
M. Luyckx,
B. Gressier,
1994,
APMIS : acta pathologica, microbiologica, et immunologica Scandinavica.
S. Lebègue,
W. Pickett,
S. Savrasov,
2008,
Physical review letters.
Z. Fisk,
S. Lebègue,
E. Bauer,
2008
.
M Alouani,
S. Lebègue,
R. Ahuja,
2008,
Proceedings of the National Academy of Sciences.
S. Lebègue,
J. Ángyán,
S. Pillet,
2008
.
S. Lebègue,
M. Luyckx,
B. Gressier,
1994,
Methods and findings in experimental and clinical pharmacology.
S. Lebègue,
M. Katsnelson,
O. Eriksson,
2006
.
T. Tyliszczak,
S. Lebègue,
J. Ibers,
2014,
Inorganic chemistry.
S. Lebègue,
M. Katsnelson,
O. Eriksson,
2006
.
S. Lebègue,
H. Garbouj,
M. Debbichi,
2023,
Physical chemistry chemical physics : PCCP.
S. Lebègue,
B. Malaman,
M. François,
2010
.
S. Lebègue,
S. Mangin,
O. Eriksson,
2023,
2301.01055.
S. Lebègue,
C. Jelsch,
N. Ghermani,
2011
.
S. Lebègue,
D. Rocca,
G. Vaitheeswaran,
2019,
Computational Materials Science.
J. Prakash,
S. Lebègue,
C. Malliakas,
2020,
Inorganic chemistry.
S. Lebègue,
R. V. Van Duyne,
J. Ibers,
2012,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2019,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
J. Ibers,
2018,
Zeitschrift für anorganische und allgemeine Chemie.
S. Lebègue,
C. Malliakas,
J. Ibers,
2015
.
S. Lebègue,
C. Malliakas,
J. Ibers,
2014,
Inorganic chemistry.
R. V. Duyne,
S. Lebègue,
J. Ibers,
2013
.
J. Prakash,
S. Lebègue,
C. Malliakas,
2018,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015,
Inorganic chemistry.
S. Lebègue,
J. Ángyán,
C. Jelsch,
2012
.
J. Prakash,
S. Lebègue,
D. Rocca,
2016
.
J. Prakash,
S. Lebègue,
R. V. Van Duyne,
2015,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2020,
Inorganic chemistry.
S. Lebègue,
B. Arnaud,
M. Alouani,
2005
.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2010
.
S. Lebègue,
M. Katsnelson,
O. Eriksson,
2005
.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015,
Inorganic chemistry.
S. Lebègue,
C. Malliakas,
J. Ibers,
2013,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2016,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015
.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2014,
Inorganic Chemistry.
J. Prakash,
S. Lebègue,
J. Ibers,
2019,
Solid State Sciences.
J. Prakash,
S. Lebègue,
C. Malliakas,
2018,
Journal of Solid State Chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015
.
J. Prakash,
S. Lebègue,
C. Malliakas,
2014,
Inorganic chemistry.
S. Lebègue,
Young-Min Kim,
Heejun Yang,
2020,
Advanced materials.
S. Lebègue,
J. Ibers,
M. Ward,
2014,
Inorganic chemistry.
J. Prakash,
S. Lebègue,
C. Malliakas,
2017
.
J. Prakash,
S. Lebègue,
J. Ibers,
2015
.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015,
Inorganic chemistry.
S. Lebègue,
M. Fischer,
M. Badawi,
2019,
The Journal of chemical physics.
S. Lebègue,
I. Filippova,
M. Badawi,
2020,
Journal of colloid and interface science.
S. Lebègue,
I. Filippova,
M. Badawi,
2019,
Chemical science.
S. Lebègue,
I. Filippova,
M. Badawi,
2018,
The journal of physical chemistry. B.
S. Lebègue,
I. Filippova,
M. Badawi,
2018,
The journal of physical chemistry. B.
S. Lebègue,
D. Ihiawakrim,
O. Ersen,
2020,
Journal of colloid and interface science.
S. Lebègue,
M. Luyckx,
B. Gressier,
1994,
Die Pharmazie.
S. Lebègue,
M. Badawi,
A. Semmeq,
2021,
Colloids and Surfaces A: Physicochemical and Engineering Aspects.
S. Lebègue,
O. Eriksson,
J. Wills,
2005
.
S. Lebègue,
M. Katsnelson,
I. D. Marco,
2009
.
S. Lebègue,
A. Elomrani,
K. Sbiaai,
2022,
Materials Chemistry and Physics.
S. Lebègue,
M. Badawi,
I. Khalil,
2019,
Molecular Systems Design & Engineering.
J. J. Kozak,
S. Lebègue,
E. Lee,
2019,
Journal of Physics: Condensed Matter.
S. Lebègue,
K. Ollefs,
A. Ney,
2012
.
S. Lebègue,
Yacine Benguerba,
M. Badawi,
2022,
Applied Surface Science.
S. Lebègue,
S. Bernard,
A. Mesbah,
2021
.
S. Lebègue,
M. Badawi,
S. Gueddida,
2020
.
S. Lebègue,
M. Badawi,
S. Gueddida,
2020,
The Journal of chemical physics.
S. Lebègue,
Hyungjun Kim,
W. Kim,
2021,
The Journal of chemical physics.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2011
.
S. Lebègue,
Ramandeep Ahuja,
M. Ramzan,
2011
.
S. Lebègue,
O. Eriksson,
P. Oppeneer,
2007
.
S. Lebègue,
J. Ángyán,
M. Marsman,
2011,
The journal of physical chemistry. A.
S. Lebègue,
F. Maugé,
M. Badawi,
2020,
Chemical Engineering Journal.
G. Vaitheeswaran,
S. Lebègue,
G. Vaitheeswaran,
2012,
1211.3512.
S. Lebègue,
M. Dhaou,
M. Debbichi,
2021,
Physical Review Applied.
S. Lebègue,
B. Arnaud,
M. Alouani,
2006
.
A Fractionally Ionic Approach to Polarizability and van der Waals Many-Body Dispersion Calculations.
T. Bučko,
S. Lebègue,
J. Ángyán,
2016,
Journal of chemical theory and computation.
T. Bučko,
S. Lebègue,
J. Ángyán,
2013,
Journal of chemical theory and computation.
S. Lebègue,
S. Ouaskit,
M. Badawi,
2017,
Physical chemistry chemical physics : PCCP.
S. Lebègue,
D. Rocca,
M. Said,
2020
.
S. Lebègue,
M. Katsnelson,
O. Eriksson,
2010,
1001.3829.
A. Tkatchenko,
S. Lebègue,
T. Björkman,
2019,
Annual Review of Materials Research.
S. Lebègue,
O. Eriksson,
I. Opahle,
2006
.
S. Lebègue,
S. Royer,
N. Canilho,
2023,
ChemCatChem.
S. Lebègue,
M. Badawi,
S. Gueddida,
2020
.
S. Lebègue,
N. Canilho,
A. Pasc,
2019,
Applied Surface Science.
S. Lebègue,
M. Driz,
N. Benkhettou,
2012
.
S. Lebègue,
S. Chibani,
M. Chebbi,
2016,
Physical chemistry chemical physics : PCCP.
T. Bučko,
S. Lebègue,
S. Chibani,
2016,
The Journal of chemical physics.
S. Lebègue,
G. Raffy,
B. Arnaud,
2016,
1602.08959.
S. Lebègue,
M. Mazroui,
M. Badawi,
2022,
Journal of Crystal Growth.
S. Lebègue,
M. Katsnelson,
I. D. Marco,
2012,
Nature Communications.
S. Lebègue,
M. Katsnelson,
C. Grazioli,
2009,
Physical review letters.
S. Lebègue,
D. Rocca,
T. Björkman,
2019,
Beilstein journal of nanotechnology.
S. Lebègue,
O. Eriksson,
P. Oppeneer,
2006
.
S. Lebègue,
O. Eriksson,
L. Debbichi,
2015,
The journal of physical chemistry letters.
S. Lebègue,
S. Mangin,
G. Malinowski,
2019
.
S. Lebègue,
S. Mangin,
G. Malinowski,
2019,
Physical Review B.
S. Lebègue,
M. Badawi,
M. Said,
2021
.
Olle Eriksson,
Risto M. Nieminen,
Mattias Klintenberg,
2013
.
Mannan Ali,
C. Marrows,
B. Hickey,
2010
.
S. Lebègue,
R. Ahuja,
A. L. Rosa,
2012
.
S. Lebègue,
O. Eriksson,
L. Debbichi,
2014
.
S. Lebègue,
G. Fiori,
G. Iannaccone,
2010,
1004.0428.
S. Lebègue,
M. Mazroui,
M. Badawi,
2022,
Surface Science.
S. Lebègue,
J. Ángyán,
P. Fertey,
2013
.
S. Lebègue,
L. Filippov,
I. Filippova,
2019,
Minerals Engineering.
S. Lebègue,
S. Chibani,
M. Badawi,
2019,
Applied Surface Science.
S. Lebègue,
D. Rocca,
C. Vallières,
2018,
Theoretical Chemistry Accounts.
S. Lebègue,
M. Badawi,
Y. Vaills,
2018,
Journal of Non-Crystalline Solids.
S. Lebègue,
D. Rocca,
M. Badawi,
2021
.
T. Bučko,
S. Lebègue,
J. Ángyán,
2014,
The Journal of chemical physics.
S. Lebègue,
G. Vaitheeswaran,
S. Appalakondaiah,
2014,
The Journal of chemical physics.
S. Lebègue,
M. Mazroui,
R. Ferrando,
2019
.
S. Lebègue,
2009
.
S. Lebègue,
W. Pickett,
Z. Yin,
2008,
0810.0376.
S. Lebègue,
T. Gould,
E. Lee,
2019
.
T. Bučko,
S. Lebègue,
J. Ángyán,
2016,
Journal of physics. Condensed matter : an Institute of Physics journal.
S. Lebègue,
J. Dobson,
T. Gould,
2013,
The Journal of chemical physics.
S. Lebègue,
J. Dobson,
T. Gould,
2013,
Journal of physics. Condensed matter : an Institute of Physics journal.
S. Lebègue,
L. Debbichi,
M. Said,
2017,
The Journal of chemical physics.
S. Lebègue,
M. Badawi,
D. Rocca,
2019,
Physica E: Low-dimensional Systems and Nanostructures.
S. Lebègue,
E. Lee,
Hyungjun Kim,
2019,
Front. Chem..
S. Lebègue,
E. Lee,
Minho Kim,
2016
.
S. Lebègue,
J. Dobson,
T. Gould,
2016
.
S. Lebègue,
O. Eriksson,
N. Skorodumova,
2010,
Journal of physics. Condensed matter : an Institute of Physics journal.
S. Lebègue,
G. Vaitheeswaran,
S. Appalakondaiah,
2013,
The Journal of chemical physics.
S. Lebègue,
P. R. Surján,
P. Reinhardt,
2018,
Theoretical Chemistry Accounts.
J F Dobson,
Tim Gould,
S. Lebègue,
2010,
Physical review letters.
T. Bučko,
S. Lebègue,
D. Rocca,
2021,
Journal of chemical theory and computation.
S. Lebègue,
O. Eriksson,
G. Vaitheeswaran,
2010,
Journal of physics. Condensed matter : an Institute of Physics journal.
S. Lebègue,
J. Ángyán,
S. Chibani,
2017,
Chemphyschem : a European journal of chemical physics and physical chemistry.
S. Lebègue,
M. Badawi,
T. Ayadi,
2022,
Physical chemistry chemical physics : PCCP.
S. Lebègue,
M. Badawi,
L. Cantrel,
2022,
Molecular Systems Design & Engineering.
S. Lebègue,
F. Banhart,
O. Eriksson,
2015,
Small.
S. Lebègue,
A. Nassour,
A. R. Benrekia,
2021
.
S. Lebègue,
T. Gould,
E. Lee,
2020,
Journal of the American Chemical Society.
S. Lebègue,
T. Gould,
D. Rocca,
2018,
The Journal of chemical physics.
S. Lebègue,
S. Royer,
J. Lamonier,
2023,
Applied Catalysis B: Environmental.
S. Lebègue,
A. Bonilla-Petriciolet,
M. Badawi,
2021,
Journal of Molecular Liquids.
S. Lebègue,
T. Aminabhavi,
M. Badawi,
2021,
Molecular Systems Design & Engineering.
S. Lebègue,
G. Fiori,
G. Iannaccone,
2010,
2010 14th International Workshop on Computational Electronics.
S. Lebègue,
B. Arnaud,
M. Alouani,
2007
.
S. Lebègue,
B. Arnaud,
M. Alouani,
2003,
cond-mat/0305381.
S. Lebègue,
M. Mazroui,
M. Badawi,
2023,
Surface Science.
S. Lebègue,
J. Ángyán,
L. Campo,
2014
.
S. Lebègue,
R. Nieminen,
T. Björkman,
2015
.
S. Lebègue,
S. Mangin,
G. Malinowski,
2022,
Journal of Magnetism and Magnetic Materials.
Hybrid localized graph kernel for machine learning energy‐related properties of molecules and solids
Fabien Pascale,
Bastien Casier,
Dario Rocca,
2020,
J. Comput. Chem..
S. Lebègue,
D. Rocca,
M. Said,
2021,
Journal of Applied Physics.
S. Lebègue,
M. Badawi,
Maha Said,
2022,
Physica E: Low-dimensional Systems and Nanostructures.
S. Lebègue,
T. Björkman,
O. Eriksson,
2016
.
S. Lebègue,
H. Mao,
R. Ahuja,
2011,
Proceedings of the National Academy of Sciences.
S. Lebègue,
2020,
Acta crystallographica Section B, Structural science, crystal engineering and materials.
Duck Young Kim,
Muhammad Ramzan,
Rajeev Ahuja,
2012,
Proceedings of the National Academy of Sciences.
S. Lebègue,
W. Pickett,
B. Arnaud,
2003,
cond-mat/0302290.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2011
.
S. Lebègue,
F. Aouaini,
S. Gueddida,
2022,
Journal of Materials Research and Technology.
S. Lebègue,
D. Rocca,
M. Said,
2017,
The Journal of chemical physics.
S. Lebègue,
T. Gould,
D. Rocca,
2018
.
Dario Rocca,
Anant Dixit,
Julien Claudot,
2017,
Journal of chemical theory and computation.
S. Lebègue,
E. Lee,
Minho Kim,
2016,
The journal of physical chemistry letters.
S. Lebègue,
T. Gould,
Jeil Jung,
2017,
1708.08614.
T. Bučko,
S. Lebègue,
J. Ángyán,
2012,
Physical chemistry chemical physics : PCCP.
R. V. Duyne,
S. Lebègue,
J. Ibers,
2013
.
S. Lebègue,
M. Debbichi,
2015
.
S. Lebègue,
D. Rocca,
A. Dixit,
2017,
The Journal of chemical physics.
J. Prakash,
S. Lebègue,
D. Rocca,
2016
.
S. Lebègue,
R. Ahuja,
M. Ramzan,
2012
.
S. Lebègue,
M. Pastore,
Dimple Dimple,
2021
.
S. Lebègue,
M. Debbichi,
L. Debbichi,
2020
.
S. Lebègue,
M. Debbichi,
L. Debbichi,
2017
.
S. Lebègue,
R. Ahuja,
Peter Larsson,
2009
.
S. Lebègue,
G. Maurin,
F. Maugé,
2018,
The Journal of Physical Chemistry C.
J. Prakash,
S. Lebègue,
C. Malliakas,
2015
.
S. Lebègue,
D. Rocca,
G. Vaitheeswaran,
2016,
Beilstein journal of nanotechnology.
S. Lebègue,
O. Eriksson,
S. Eriksson,
2009,
0901.0440.
W. Zhang,
S. Lebègue,
S. Mangin,
2023,
2301.01055.
Electronic and optical properties of α, γ, and β phases of MgH2: A first-principles GW investigation
S. Lebègue,
R. Ahuja,
B. Arnaud,
2005
.
S. Lebègue,
B. Malaman,
M. François,
2014,
Inorganic chemistry.
S. Lebègue,
S. Mangin,
Sangeeta Sharma,
2021,
Nano letters.
T. Bučko,
S. Lebègue,
J. Ángyán,
2014,
The Journal of chemical physics.
S. Lebègue,
M. Katsnelson,
I. D. Marco,
2012
.
S. Lebègue,
T. Gould,
E. Lee,
2019
.
T. Bučko,
S. Lebègue,
A. Gallo,
2024,
npj Computational Materials.