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High-Throughput Survey of Ordering Configurations in MXene Alloys Across Compositions and Temperatures

ACS nano, 2017-05, Vol.11 (5), p.4407-4418

2017

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Thioamide‐Directed Cobalt(III)‐Catalyzed Selective Amidation of C(sp3)−H Bonds

Angewandte Chemie International Edition, 2017-12, Vol.56 (52), p.16550-16554

International ed. in English, 2017

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Surface charge as activity descriptors for electrochemical CO2 reduction to multi-carbon products on organic-functionalised Cu

Nature communications, 2023-01, Vol.14 (1), p.335-335, Article 335

2023

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Natural tri- to hexapeptides self-assemble in water to amyloid β-type fiber aggregates by unexpected α-helical intermediate structures

Proceedings of the National Academy of Sciences - PNAS, 2011-01, Vol.108 (4), p.1361-1366

2011

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Step Flow Versus Mosaic Film Growth in Hexagonal Boron Nitride

Journal of the American Chemical Society, 2013-02, Vol.135 (6), p.2368-2373

2013

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Site specificity of halogen bonding involving aromatic acceptors

Physical chemistry chemical physics : PCCP, 2018, Vol.20 (13), p.8685-8694

2018

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Multi Band Gap Electronic Structure in CH3NH3PbI3

Scientific reports, 2019-02, Vol.9 (1), p.2144-2144, Article 2144

2019

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Author Correction: Surface charge as activity descriptors for electrochemical CO2 reduction to multi-carbon products on organic-functionalised Cu

Nature communications, 2023-07, Vol.14 (1), p.4068-4068, Article 4068

2023

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SEC-BADAEC: An Efficient ECC With No Vacancy for Strong Memory Protection

IEEE access, 2022, Vol.10, p.89769-89780

2022

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Study of Pd-Au bimetallic catalysts for CO oxidation reaction by DFT calculations

Physical chemistry chemical physics : PCCP, 2009-01, Vol.11 (9), p.1441-1446

2009

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CO2 Reforming of Ethanol: Density Functional Theory Calculations, Microkinetic Modeling, and Experimental Studies

ACS catalysis, 2020-08, Vol.10 (16), p.9624-9633

2020

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EPIC STAR: a reliable and efficient approach for phonon- and impurity-limited charge transport calculations

npj computational materials, 2020-05, Vol.6 (1), Article 46

2020

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Unravelling V6O13 Diffusion Pathways via CO2 Modification for High-Performance Zinc Ion Battery Cathode

ACS nano, 2021-01, Vol.15 (1), p.1273-1281

2021

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Computational Investigation of the 1,4-Rh Shift in the [(Ph2PCH2CH2PPh2)Rh]-Catalyzed Alkyne Arylation Reaction

European journal of organic chemistry, 2015-11, Vol.2015 (32), p.7114-7121

2015

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Thiophene-Containing Pechmann Dye Derivatives

Organic letters, 2010-11, Vol.12 (21), p.4816-4819

2010

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Electronic transport descriptors for the rapid screening of thermoelectric materials

Materials horizons, 2021-08, Vol.8 (9), p.2463-2474

2021

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Making Convolutions Resilient via Algorithm-Based Error Detection Techniques

IEEE transactions on dependable and secure computing, 2022-07, Vol.19 (4), p.1-1

2022

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Horace's Programmatic Priamel

The Journal of Roman studies, 2021-11, Vol.111, p.49-73

Sullivan, Michael B.

2021

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Selective and Stable CO2 Electroreduction to CH4 via Electronic Metal–Support Interaction upon Decomposition/Redeposition of MOF

Small (Weinheim an der Bergstrasse, Germany), 2023-10, Vol.19 (41), p.e2301379-e2301379

2023

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Unraveling the Synergistic Effect of Re and Cs Promoters on Ethylene Epoxidation over Silver Catalysts with Machine Learning-Accelerated First-Principles Simulations

ACS catalysis, 2022-02, Vol.12 (4), p.2540-2551

2022

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Multi Band Gap Electronic Structure in CH 3 NH 3 PbI 3

Scientific reports, 2019-12, Vol.9 (1), p.2144

2019

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First-Principles Characterization of Lithium Cobalt Pyrophosphate as a Cathode Material for Solid-State Li-Ion Batteries

Journal of physical chemistry. C, 2019-12, Vol.123 (49), p.29623-29629

2019

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Micro CT Analysis of Spine Architecture in a Mouse Model of Scoliosis

Frontiers in endocrinology (Lausanne), 2015-03, Vol.6, p.38-38

2015

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Building better lithium-sulfur batteries: from LiNO3 to solid oxide catalyst

Scientific reports, 2016-09, Vol.6 (1), p.33154-33154, Article 33154

2016

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Lithium monoxide anion: A ground-state triplet with the strongest base to date

Proceedings of the National Academy of Sciences - PNAS, 2008-06, Vol.105 (22), p.7647-7651

2008

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High-Throughput Survey of Ordering Configurations in MXene Alloys Across Compositions and Temperatures

Thioamide‐Directed Cobalt(III)‐Catalyzed Selective Amidation of C(sp3)−H Bonds

Surface charge as activity descriptors for electrochemical CO2 reduction to multi-carbon products on organic-functionalised Cu

Natural tri- to hexapeptides self-assemble in water to amyloid β-type fiber aggregates by unexpected α-helical intermediate structures

Step Flow Versus Mosaic Film Growth in Hexagonal Boron Nitride

Site specificity of halogen bonding involving aromatic acceptors

Multi Band Gap Electronic Structure in CH3NH3PbI3

Author Correction: Surface charge as activity descriptors for electrochemical CO2 reduction to multi-carbon products on organic-functionalised Cu

SEC-BADAEC: An Efficient ECC With No Vacancy for Strong Memory Protection

Study of Pd-Au bimetallic catalysts for CO oxidation reaction by DFT calculations

CO2 Reforming of Ethanol: Density Functional Theory Calculations, Microkinetic Modeling, and Experimental Studies

EPIC STAR: a reliable and efficient approach for phonon- and impurity-limited charge transport calculations

Unravelling V6O13 Diffusion Pathways via CO2 Modification for High-Performance Zinc Ion Battery Cathode

Computational Investigation of the 1,4-Rh Shift in the [(Ph2PCH2CH2PPh2)Rh]-Catalyzed Alkyne Arylation Reaction

Thiophene-Containing Pechmann Dye Derivatives

Electronic transport descriptors for the rapid screening of thermoelectric materials

Making Convolutions Resilient via Algorithm-Based Error Detection Techniques

Horace's Programmatic Priamel

Selective and Stable CO2 Electroreduction to CH4 via Electronic Metal–Support Interaction upon Decomposition/Redeposition of MOF

Unraveling the Synergistic Effect of Re and Cs Promoters on Ethylene Epoxidation over Silver Catalysts with Machine Learning-Accelerated First-Principles Simulations

Multi Band Gap Electronic Structure in CH 3 NH 3 PbI 3

First-Principles Characterization of Lithium Cobalt Pyrophosphate as a Cathode Material for Solid-State Li-Ion Batteries

Micro CT Analysis of Spine Architecture in a Mouse Model of Scoliosis

Building better lithium-sulfur batteries: from LiNO3 to solid oxide catalyst

Lithium monoxide anion: A ground-state triplet with the strongest base to date

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