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Epitaxial Synthesis of Blue Phosphorene

Small (Weinheim an der Bergstrasse, Germany), 2018-12, Vol.14 (51), p.e1804066-n/a

2018

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Graphene–Ionic Liquid Interfacial Potential Drop from Density Functional Theory-Based Molecular Dynamics Simulations

Journal of physical chemistry. C, 2020-09, Vol.124 (36), p.19548-19555

2020

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Boron Nitride on Cu(111): An Electronically Corrugated Monolayer

Nano letters, 2012-11, Vol.12 (11), p.5821-5828

2012

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Locally strained hexagonal boron nitride nanosheets quantified by nanoscale infrared spectroscopy

Nanoscale, 2023-07, Vol.15 (28), p.11972-1198

2023

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Supramolecular control of the magnetic anisotropy in two-dimensional high-spin Fe arrays at a metal interface

Nature materials, 2009-03, Vol.8 (3), p.189-193

2009

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Five-Vertex Lanthanide Coordination on Surfaces: A Route to Sophisticated Nanoarchitectures and Tessellations

Journal of physical chemistry. C, 2014-06, Vol.118 (24), p.12908-12915

2014

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Chemical Transformations Drive Complex Self-Assembly of Uracil on Close-Packed Coinage Metal Surfaces

ACS nano, 2012-03, Vol.6 (3), p.2477-2486

2012

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Coverage Effect of the CO2 Adsorption Mechanisms on CeO2(111) by First Principles Analysis

Journal of physical chemistry. C, 2013-01, Vol.117 (4), p.1701-1711

2013

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Epitaxial hexagonal boron nitride on Ir(111): A work function template

Physical review. B, Condensed matter and materials physics, 2014-06, Vol.89 (23), Article 235429

2014

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Metalation of Porphyrins by Lanthanide Atoms at Interfaces: Direct Observation and Stimulation of Cerium Coordination to 2H-TPP/Ag(111)

Journal of physical chemistry. C, 2018-03, Vol.122 (9), p.5083-5092

2018

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Structural and electronic properties of a large-scale Moiré pattern of hexagonal boron nitride on Cu(111) studied with density functional theory

Nanoscale, 2013-06, Vol.5 (12), p.5589-5595

2013

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Structure and stability of graphene nanoribbons in oxygen, carbon dioxide, water, and ammonia

Physical review. B, Condensed matter and materials physics, 2010-09, Vol.82 (11), Article 115425

2010

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Benchmarking van der Waals-treated DFT: The case of hexagonal boron nitride and graphene on Ir(111)

Physical review materials, 2019-08, Vol.3 (8), Article 084001

2019

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Electronic Structure of an Organic/Metal Interface: Pentacene/Cu(110)

Journal of physical chemistry. C, 2012-11, Vol.116 (44), p.23465-23471

2012

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Site-specific electronic and geometric interface structure of Co-tetraphenyl-porphyrin layers on Ag(111)

Physical review. B, Condensed matter and materials physics, 2010-06, Vol.81 (24), Article 245403

2010

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Dehalogenation and Coupling of a Polycyclic Hydrocarbon on an Atomically Thin Insulator

ACS nano, 2014-07, Vol.8 (7), p.6571-6579

2014

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Melting temperature of water: DFT-based molecular dynamics simulations with D3 dispersion correction

Physical review. B, 2016-11, Vol.94 (18), Article 184111

2016

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Silicene’s pervasive surface alloy on Ag(111): a scaffold for two-dimensional growth

2d materials, 2022-10, Vol.9 (4), p.45021

2022

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Charge State Control of F16CoPc on h‐BN/Cu(111)

Advanced materials interfaces, 2020-08, Vol.7 (15), p.n/a

2020

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First-principles calculations of x-ray absorption in a scheme based on ultrasoft pseudopotentials: From α -quartz to high- T c compounds

Physical review. B, Condensed matter and materials physics, 2009-08, Vol.80 (7), Article 075102

2009

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First-principles theory of orbital magnetization

Physical review. B, Condensed matter and materials physics, 2010-02, Vol.81 (6), Article 060409

2010

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Charge-density correlations in pressurized liquid lithium calculated using ab initio molecular dynamics

Physical review. B, Condensed matter and materials physics, 2014-07, Vol.90 (1), Article 014202

2014

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Irregular stacking sequence in the initial growth of ultrathin Rh films on Ru(0001)

Physical review. B, Condensed matter and materials physics, 2005-08, Vol.72 (7), p.075432.1-075432.6, Article 075432

2005

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Photoelectron diffraction in the x-ray and ultraviolet regime: Sn-phthalocyanine on Ag(111)

Physical review. B, Condensed matter and materials physics, 2013-02, Vol.87 (8), Article 085429

2013

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First steps of blue phosphorene growth on Au(111)

Materials today : proceedings, 2021-01, Vol.39, p.1153-1156

2021

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Epitaxial Synthesis of Blue Phosphorene

Graphene–Ionic Liquid Interfacial Potential Drop from Density Functional Theory-Based Molecular Dynamics Simulations

Boron Nitride on Cu(111): An Electronically Corrugated Monolayer

Locally strained hexagonal boron nitride nanosheets quantified by nanoscale infrared spectroscopy

Supramolecular control of the magnetic anisotropy in two-dimensional high-spin Fe arrays at a metal interface

Five-Vertex Lanthanide Coordination on Surfaces: A Route to Sophisticated Nanoarchitectures and Tessellations

Chemical Transformations Drive Complex Self-Assembly of Uracil on Close-Packed Coinage Metal Surfaces

Coverage Effect of the CO2 Adsorption Mechanisms on CeO2(111) by First Principles Analysis

Epitaxial hexagonal boron nitride on Ir(111): A work function template

Metalation of Porphyrins by Lanthanide Atoms at Interfaces: Direct Observation and Stimulation of Cerium Coordination to 2H-TPP/Ag(111)

Structural and electronic properties of a large-scale Moiré pattern of hexagonal boron nitride on Cu(111) studied with density functional theory

Structure and stability of graphene nanoribbons in oxygen, carbon dioxide, water, and ammonia

Benchmarking van der Waals-treated DFT: The case of hexagonal boron nitride and graphene on Ir(111)

Electronic Structure of an Organic/Metal Interface: Pentacene/Cu(110)

Site-specific electronic and geometric interface structure of Co-tetraphenyl-porphyrin layers on Ag(111)

Dehalogenation and Coupling of a Polycyclic Hydrocarbon on an Atomically Thin Insulator

Melting temperature of water: DFT-based molecular dynamics simulations with D3 dispersion correction

Silicene’s pervasive surface alloy on Ag(111): a scaffold for two-dimensional growth

Charge State Control of F16CoPc on h‐BN/Cu(111)

First-principles calculations of x-ray absorption in a scheme based on ultrasoft pseudopotentials: From α -quartz to high- T c compounds

First-principles theory of orbital magnetization

Charge-density correlations in pressurized liquid lithium calculated using ab initio molecular dynamics

Irregular stacking sequence in the initial growth of ultrathin Rh films on Ru(0001)

Photoelectron diffraction in the x-ray and ultraviolet regime: Sn-phthalocyanine on Ag(111)

First steps of blue phosphorene growth on Au(111)

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