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Physical Chemistry

Working Paper

XPS of Cold Pressed Multilayered and Freestanding Delaminated 2D Thin Films of Mo2TiC2Tz and Mo2Ti2C3Tz (MXenes)

Joseph Halim, Kevin Cook, Per Eklund, johanna Rosen, Michel W. Barsoum

Version 1 posted 30 May 2019

625

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Physical Chemistry

Working Paper

Energetics at the Edge: Direct Optical Mapping of Bulk and Interfacial Electronic Structure in CdSe Quantum Dots using Broadband Electronic Sum Frequency Generation Microspectroscopy

Brianna R. Watson, Benjamin Doughty, Tessa Calhoun

Version 1 posted 29 May 2019

481

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Inorganic Chemistry

Working Paper

Noncollinear Relativistic DFT+U Calculations of Actinide Dioxide Surfaces

James Pegg, Ashley E. Shields, Mark T. Storr, David Scanlon, Nora De Leeuw

Version 1 posted 03 October 2018

703

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Materials Science

Working Paper

Understanding Energy Conversion and Loss Mechanisms in Ternary Metal Oxide Photoelectrodes: The Case of Copper Vanadate

Chang-Ming Jiang, Gideon Segev, Lucas H. Hess, Guiji Liu, Gregory Zaborski, Francesca M. Toma, Jason K. Cooper, Ian D. Sharp

Version 1 posted 20 October 2017

917

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Physical Chemistry

Working Paper

Emergence of Selectivity in Inherently Nonselective Gold Nanoparticles Through Preferential Breaking of Interparticle Interactions

Anish Rao, Govind Sasi Kumar, Soumendu Roy, Ajesh T. R., Gayathri Devatha, Pramod Pillai

Version 1 posted 15 October 2018

592

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Materials Science

Working Paper

Resorcin[4]arene-Based Multidentate Phosphate Ligands with Superior Binding Affinity for Nanocrystal Surfaces

Suren J. Nemat, Loren Deblock, Dietger Van den Eynden, Michael Heilmann, Jesper Köster, Konrad Tiefenbacher, Jonathan De Roo

Version 1 posted 13 January 2021

285

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Materials Science

Working Paper

The Search for Molecular Corks Beyond Carbon Monoxide: A Quantum Mechanical Study of N-Heterocyclic Carbene Adsorption on Pd/Cu(111) and Pt/Cu(111) Single Atom Alloys

Scott Simpson

Version 1 posted 10 February 2021

212

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Nanoscience

Working Paper

A Simple and Soft Chemical Deaggregation Method Producing Single-Digit Detonation Nanodiamonds

Daiki Terada, Frederick T.-K. So, Bodo Hattendorf, Eiji Ōsawa, Masahiro Shirakawa, Ryuji Igarashi, Takuya Segawa

Version 1 posted 07 December 2020

399

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Physical Chemistry

Working Paper

Heterogeneous Adsorption and Local Ordering of Formate on a Magnetite Surface

Marcus Creutzburg, Kai Sellschopp, Steffen Tober, Elin Grånäs, Vedran Vonk, Wernfried Mayr-Schmölzer, Stefan Müller, Heshmat Noei, Gregor Vonbun-Feldbauer, Andreas Stierle

Version 1 posted 20 January 2021

305

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1

Citations

Materials Chemistry

Working Paper

Density Matrix Embedding Using Multiconfiguration Pair-Density Functional Theory

Abhishek Mitra, Matthew Hermes, Laura Gagliardi

Version 2 posted 13 March 2023

260

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53 results in surface chemistry in Keywords: surface chemistry

XPS of Cold Pressed Multilayered and Freestanding Delaminated 2D Thin Films of Mo2TiC2Tz and Mo2Ti2C3Tz (MXenes)

Energetics at the Edge: Direct Optical Mapping of Bulk and Interfacial Electronic Structure in CdSe Quantum Dots using Broadband Electronic Sum Frequency Generation Microspectroscopy

Noncollinear Relativistic DFT+U Calculations of Actinide Dioxide Surfaces

Understanding Energy Conversion and Loss Mechanisms in Ternary Metal Oxide Photoelectrodes: The Case of Copper Vanadate

Emergence of Selectivity in Inherently Nonselective Gold Nanoparticles Through Preferential Breaking of Interparticle Interactions

Resorcin[4]arene-Based Multidentate Phosphate Ligands with Superior Binding Affinity for Nanocrystal Surfaces

The Search for Molecular Corks Beyond Carbon Monoxide: A Quantum Mechanical Study of N-Heterocyclic Carbene Adsorption on Pd/Cu(111) and Pt/Cu(111) Single Atom Alloys

A Simple and Soft Chemical Deaggregation Method Producing Single-Digit Detonation Nanodiamonds

Heterogeneous Adsorption and Local Ordering of Formate on a Magnetite Surface

Density Matrix Embedding Using Multiconfiguration Pair-Density Functional Theory

53 results in Keywords: surface chemistry