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SANVITO, STEFANO (120)
RUNGGER, IVAN (28)
ARCHER, THOMAS (4)
NARAYAN, AWADHESH (4)
BAADJI, NADJIB (3)
CAFFREY, NUALA (3)
COEY, JOHN (3)
MOTTA, CARLO (3)
RODE, KARSTEN (3)
VENKATESAN, MUNUSWAMY (3)
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Nanoscience & Materials (68)
Physics (18)
Condensed matter physics (10)
Atomic, molecular and chemical physics (6)
Electrodes (4)
density functional theory (3)
Fermi levels (3)
Gold (3)
Co-doped ZnO (2)
Density functional theory (2)
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2018 (2)
2017 (13)
2016 (13)
2015 (5)
2014 (13)
2013 (24)
2012 (23)
2011 (16)
2010 (11)
Sponsor
Science Foundation Ireland (SFI) (81)
Irish Research Council for Science and Engineering Technology (IRCSET) (8)
European Commission (7)
European Union (EU) (7)
European Research Council (ERC) (4)
Other (4)
Science Foundation Ireland (3)
European Union Framework Programme 7 (FP7) (2)
National Natural Science Foundation of China (60703033). (2)
European Union Seventh Framework Program (1)
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"Scattered surface charge density: A tool for surface characterization"
SANVITO, STEFANO
;
NAYDENOV, BORISLAV
;
BOLAND, JOHN
;
RUNGGER, IVAN
;
MANTEGA, MAURO
(
2011
)
Variational pseudo-self-interaction-corrected density functional approach to the ab initio description of correlated solids and molecules
SANVITO, STEFANO
;
PEMMARAJU, SRI
(
2011
)
Spin transport in higher n-acene molecules
SANVITO, STEFANO
;
ARCHER, THOMAS
;
RUNGGER, IVAN
(
2011
)
Quantum transport of Au-S-S-Au nanoscale junctions
SANVITO, STEFANO
(
2012
)
Exchange interactions and magnetic phases of transition metal oxides: Benchmarking advanced ab initio methods
SANVITO, STEFANO
;
ARCHER, THOMAS DAVID
(
2011
)
Persistent current and Drude weight for the one-dimensional Hubbard model from current lattice density functional theory
SANVITO, STEFANO
;
AKANDE, AKINLOLU
(
2012
)
Spin-polarized transport through single-molecule magnet Mn6 complexes
SANVITO, STEFANO
(
2013
)
Atomistic simulations of highly conductive molecular transport junctions under realistic conditions
SANVITO, STEFANO
;
RUNGGER, IVAN
(
2013
)
First-principles investigation on the electronic efficiency and binding energy of the contacts formed by graphene and poly-aromatic hydrocarbon anchoring groups
SANVITO, STEFANO
(
2015
)
Revealing the role of organic cations in hybrid halide perovskite CH<inf>3</inf> NH<inf>3</inf>PbI<inf>3</inf>
SANVITO, STEFANO
;
MOTTA, CARLO
(
2015
)
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