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Long-range magnetic order in a purely organic 2D layer adsorbed on epitaxial graphene

Nature physics, 2013-06, Vol.9 (6), p.368-374

2013

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Determination of low-strain interfaces via geometric matching

Physical review. B, 2017-08, Vol.96 (8), Article 085306

2017

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Controlling the spatial arrangement of organic magnetic anions adsorbed on epitaxial graphene on Ru(0001)

Nanoscale, 2014-12, Vol.6 (24), p.15271-15279

2014

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A density functional theory study of the manganese-phthalocyanine

Theoretical chemistry accounts, 2011-03, Vol.128 (4-6), p.497-503

2011

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Method for determining optimal supercell representation of interfaces

Journal of physics. Condensed matter, 2017-05, Vol.29 (18), p.185901-185901

2017

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Manipulating the voltage drop in graphene nanojunctions using a gate potential

Physical chemistry chemical physics : PCCP, 2016-01, Vol.18 (2), p.1025-1031

2016

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QuantumATK: an integrated platform of electronic and atomic-scale modelling tools

Journal of physics. Condensed matter, 2020-01, Vol.32 (1), p.015901-015901

2020

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General atomistic approach for modeling metal-semiconductor interfaces using density functional theory and nonequilibrium Green's function

Physical review. B, 2016-04, Vol.93 (15), Article 155302

2016

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First-principles Green's-function method for surface calculations: A pseudopotential localized basis set approach

Physical review. B, 2017-11, Vol.96 (19), Article 195309

2017

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Field Effect in Graphene-Based van der Waals Heterostructures: Stacking Sequence Matters

Nano letters, 2017-04, Vol.17 (4), p.2660-2666

2017

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Proximity Band Structure and Spin Textures on Both Sides of Topological-Insulator/Ferromagnetic-Metal Interface and Their Charge Transport Probes

Nano letters, 2017-09, Vol.17 (9), p.5626-5633

2017

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Schottky barrier lowering due to interface states in 2D heterophase devices

Nanoscale advances, 2021-01, Vol.3 (2), p.567-574

2021

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Manipulating the voltage drop in graphene nanojunctions using a gate potentialElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp04613k

2015-12

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Electron-phonon scattering from Green's function transport combined with molecular dynamics: Applications to mobility predictions

Physical review. B, 2017-06, Vol.95 (24), p.245210, Article 245210

2017

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Tunneling spectra of graphene on copper unraveled

Physical chemistry chemical physics : PCCP, 2016-06, Vol.18 (25), p.17081-17090

2016

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Tunneling spectra of graphene on copper unraveledElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp01572g

2016-06

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Organic Covalent Patterning of Nanostructured Graphene with Selectivity at the Atomic Level

Nano letters, 2016-01, Vol.16 (1), p.355-361

2016

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Atomistic Insight into the Formation of Metal-Graphene One-Dimensional Contacts

Physical review applied, 2018-08, Vol.10 (2), Article 024016

2018

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Spontaneous breaking of time-reversal symmetry at the edges of 1T′ monolayer transition metal dichalcogenides

Physical review. B, 2019-04, Vol.99 (15), p.155420

2019

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Understanding the self-assembly of TCNQ on Cu(111): a combined study based on scanning tunnelling microscopy experiments and density functional theory simulations

RSC advances, 2016-01, Vol.6 (18), p.1571-1579

2016

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Elastic Response of Graphene Nanodomes

ACS nano, 2013-04, Vol.7 (4), p.2927-2934

2013

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Probing the Site-Dependent Kondo Response of Nanostructured Graphene with Organic Molecules

Nano letters, 2014-08, Vol.14 (8), p.4560-4567

2014

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A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport

Journal of physics. Condensed matter, 2011-08, Vol.23 (33), p.334215-6

2011

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Spontaneous breaking of time-reversal symmetry at the edges of 1 T ′ monolayer transition metal dichalcogenides

Physical review. B, 2019-04, Vol.99 (15), Article 155420

2019

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A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport : SEMICONDUCTING OXIDES

Journal of physics. Condensed matter, 2011, Vol.23 (33)

2011

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Long-range magnetic order in a purely organic 2D layer adsorbed on epitaxial graphene

Determination of low-strain interfaces via geometric matching

Controlling the spatial arrangement of organic magnetic anions adsorbed on epitaxial graphene on Ru(0001)

A density functional theory study of the manganese-phthalocyanine

Method for determining optimal supercell representation of interfaces

Manipulating the voltage drop in graphene nanojunctions using a gate potential

QuantumATK: an integrated platform of electronic and atomic-scale modelling tools

General atomistic approach for modeling metal-semiconductor interfaces using density functional theory and nonequilibrium Green's function

First-principles Green's-function method for surface calculations: A pseudopotential localized basis set approach

Field Effect in Graphene-Based van der Waals Heterostructures: Stacking Sequence Matters

Proximity Band Structure and Spin Textures on Both Sides of Topological-Insulator/Ferromagnetic-Metal Interface and Their Charge Transport Probes

Schottky barrier lowering due to interface states in 2D heterophase devices

Manipulating the voltage drop in graphene nanojunctions using a gate potentialElectronic supplementary information (ESI) available. See DOI: 10.1039/c5cp04613k

Electron-phonon scattering from Green's function transport combined with molecular dynamics: Applications to mobility predictions

Tunneling spectra of graphene on copper unraveled

Tunneling spectra of graphene on copper unraveledElectronic supplementary information (ESI) available. See DOI: 10.1039/c6cp01572g

Organic Covalent Patterning of Nanostructured Graphene with Selectivity at the Atomic Level

Atomistic Insight into the Formation of Metal-Graphene One-Dimensional Contacts

Spontaneous breaking of time-reversal symmetry at the edges of 1T′ monolayer transition metal dichalcogenides

Understanding the self-assembly of TCNQ on Cu(111): a combined study based on scanning tunnelling microscopy experiments and density functional theory simulations

Elastic Response of Graphene Nanodomes

Probing the Site-Dependent Kondo Response of Nanostructured Graphene with Organic Molecules

A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport

Spontaneous breaking of time-reversal symmetry at the edges of 1 T ′ monolayer transition metal dichalcogenides

A theoretical study of a ZnO graphene analogue: adsorption on Ag(111) and hydrogen transport : SEMICONDUCTING OXIDES

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