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Structure and chemistry of graphene oxide in liquid water from first principles

Nature communications, 2020-03, Vol.11 (1), p.1566-1566, Article 1566

2020

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New avenues for the large-scale harvesting of blue energy

Nature reviews. Chemistry, 2017-11, Vol.1 (11), Article 0091

2017

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Versatile electrification of two-dimensional nanomaterials in water

Nature communications, 2019-04, Vol.10 (1), p.1656-1656, Article 1656

2019

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Direct observation of water-mediated single-proton transport between hBN surface defects

Nature nanotechnology, 2020-07, Vol.15 (7), p.598-604

2020

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Unified non-equilibrium simulation methodology for flow through nanoporous carbon membrane

The Journal of chemical physics, 2023-07, Vol.159 (1)

2023

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Chemisorbed vs physisorbed surface charge and its impact on electrokinetic transport: Carbon vs boron nitride surface

The Journal of chemical physics, 2022-01, Vol.156 (4), p.044703-044703

2022

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Chemisorption of Hydroxide on 2D Materials from DFT Calculations: Graphene versus Hexagonal Boron Nitride

The journal of physical chemistry letters, 2016-11, Vol.7 (22), p.4695-4700

2016

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Spin in a Closed‐Shell Organic Molecule on a Metal Substrate Generated by a Sigmatropic Reaction

Angewandte Chemie International Edition, 2019-01, Vol.58 (3), p.821-824

International ed. in English, 2019

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Fluctuation-induced quantum friction in nanoscale water flows

Nature (London), 2022-02, Vol.602 (7895), p.84-90

2022

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Covalent Functionalization by Cycloaddition Reactions of Pristine Defect-Free Graphene

ACS nano, 2017-01, Vol.11 (1), p.627-634

2017

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Monolayer Graphene and h-BN on Metal Substrates as Versatile Templates for Metallic Nanoclusters

The journal of physical chemistry letters, 2011-09, Vol.2 (18), p.2341-2345

2011

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In‐Situ Growth of Gadolinium Phthalocyaninato Sandwich Complexes on the Ag(111) Surface

Chemphyschem, 2019-09, Vol.20 (18), p.2301-2304

2019

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Enhanced interfacial water dissociation on a hydrated iron porphyrin single-atom catalyst in graphene

Communications chemistry, 2023-11, Vol.6 (1), p.236-236, Article 236

2023

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Surface-Guided Formation of an Organocobalt Complex

Angewandte Chemie International Edition, 2016-05, Vol.55 (19), p.5754-5759

International ed. in English, 2016

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Fusing tetrapyrroles to graphene edges by surface-assisted covalent coupling

Nature chemistry, 2017-01, Vol.9 (1), p.33-38

2017

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Nature of the bias-dependent symmetry reduction of iron phthalocyanine on Cu(111)

Physical review. B, Condensed matter and materials physics, 2015-08, Vol.92 (7), Article 075428

2015

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Coupled Interactions at the Ionic Graphene-Water Interface

Physical review letters, 2023-02, Vol.130 (7), p.076201-076201, Article 076201

2023

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Spin in a Closed‐Shell Organic Molecule on a Metal Substrate Generated by a Sigmatropic Reaction

Angewandte Chemie, 2019-01, Vol.131 (3), p.831-834

2019

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A sum rule for inelastic electron tunneling spectroscopy: an ab initio study of a donor (TTF) and acceptors (TCNE, TCNQ and DCNQI) parallelly oriented on Cu(100)

Physical chemistry chemical physics : PCCP, 2013-01, Vol.15 (38), p.16111-16119

2013

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Probing Nitrosyl Ligation of Surface-Confined Metalloporphyrins by Inelastic Electron Tunneling Spectroscopy

ACS nano, 2013-06, Vol.7 (6), p.5273-5281

2013

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Ethene Epoxidation Selectivity Inhibited by Twisted Oxametallacycle: A DFT Study on Ag Surface-Oxide

Journal of the American Chemical Society, 2005-12, Vol.127 (49), p.17207-17215

2005

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Spontaneous liquid water dissociation on hybridised boron nitride and graphene atomic layers from ab initio molecular dynamics simulations

Physical chemistry chemical physics : PCCP, 2020-05, Vol.22 (19), p.10710-10716

2020

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Efficient Spin-Flip Excitation of a Nickelocene Molecule

Nano letters, 2017-03, Vol.17 (3), p.1877-1882

2017

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Reaction of Phthalocyanines with Graphene on Ir(111)

Journal of the American Chemical Society, 2015-07, Vol.137 (29), p.9452-9458

2015

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Adsorption of ammonia on multilayer iron phthalocyanine

The Journal of chemical physics, 2011-03, Vol.134 (11), p.114711-114711-7

2011

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Structure and chemistry of graphene oxide in liquid water from first principles

New avenues for the large-scale harvesting of blue energy

Versatile electrification of two-dimensional nanomaterials in water

Direct observation of water-mediated single-proton transport between hBN surface defects

Unified non-equilibrium simulation methodology for flow through nanoporous carbon membrane

Chemisorbed vs physisorbed surface charge and its impact on electrokinetic transport: Carbon vs boron nitride surface

Chemisorption of Hydroxide on 2D Materials from DFT Calculations: Graphene versus Hexagonal Boron Nitride

Spin in a Closed‐Shell Organic Molecule on a Metal Substrate Generated by a Sigmatropic Reaction

Fluctuation-induced quantum friction in nanoscale water flows

Covalent Functionalization by Cycloaddition Reactions of Pristine Defect-Free Graphene

Monolayer Graphene and h-BN on Metal Substrates as Versatile Templates for Metallic Nanoclusters

In‐Situ Growth of Gadolinium Phthalocyaninato Sandwich Complexes on the Ag(111) Surface

Enhanced interfacial water dissociation on a hydrated iron porphyrin single-atom catalyst in graphene

Surface-Guided Formation of an Organocobalt Complex

Fusing tetrapyrroles to graphene edges by surface-assisted covalent coupling

Nature of the bias-dependent symmetry reduction of iron phthalocyanine on Cu(111)

Coupled Interactions at the Ionic Graphene-Water Interface

Spin in a Closed‐Shell Organic Molecule on a Metal Substrate Generated by a Sigmatropic Reaction

A sum rule for inelastic electron tunneling spectroscopy: an ab initio study of a donor (TTF) and acceptors (TCNE, TCNQ and DCNQI) parallelly oriented on Cu(100)

Probing Nitrosyl Ligation of Surface-Confined Metalloporphyrins by Inelastic Electron Tunneling Spectroscopy

Ethene Epoxidation Selectivity Inhibited by Twisted Oxametallacycle: A DFT Study on Ag Surface-Oxide

Spontaneous liquid water dissociation on hybridised boron nitride and graphene atomic layers from ab initio molecular dynamics simulations

Efficient Spin-Flip Excitation of a Nickelocene Molecule

Reaction of Phthalocyanines with Graphene on Ir(111)

Adsorption of ammonia on multilayer iron phthalocyanine

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