Publications

Tips on using this search form

All search terms are case-insensitive
If you specify more than one search option (e.g. you search for both "Authors" and "Paper title") then the publications returned will be those that match all of your search terms
To reset the search form, click here

Currently displaying 2161 - 2180 of 30447 publications

Every atom counts: predicting sites of reaction based on chemistry within two bonds

CC Lam, JM Goodman

Digital Discovery

(2024)

1878

(doi: 10.1039/d4dd00092g)

easyunfold: A Python package for unfolding electronic band structures

B Zhu, SR Kavanagh, D Scanlon

The Journal of Open Source Software

(2024)

5974

(doi: 10.21105/joss.05974)

Jobflow: Computational Workflows Made Simple

AS Rosen, M Gallant, J George, J Riebesell, H Sahasrabuddhe, J-X Shen, M Wen, ML Evans, G Petretto, D Waroquiers, G-M Rignanese, KA Persson, A Jain, AM Ganose

Journal of Open Source Software

(2024)

5995

(doi: 10.21105/joss.05995)

Investigations of Catalysts Which Utilise Non-Covalent Interactions to Control Enantioselectivity in Rhodium-Catalysed Amination of C(sp3)–H Bonds

K Paterson

(2023)

Front Cover: Sodium Tetrakis(hexafluoroisopropyloxy)aluminates: Synthesis and Electrochemical Characterisation of a Room‐Temperature Solvated Ionic Liquid (ChemElectroChem 2/2024)

DMC Ould, S Menkin, HE Smith, V Riesgo‐González, TH Smith, MNB Chinn, E Jónsson, AD Bond, CP Grey, DS Wright

ChemElectroChem

(2023)

e202300818

(doi: 10.1002/celc.202300818)

Investigations of Catalysts Which Utilise Non-Covalent Interactions to Control Enantioselectivity in Rhodium-Catalysed Amination of C(sp3)–H Bonds

K Paterson

(2023)

(doi: 10.17863/CAM.108747)

Exploring the Landscape of Heterocyclic Quinones for Redox Flow Batteries.

RB Jethwa, D Hey, RN Kerber, AD Bond, DS Wright, CP Grey

ACS applied energy materials

(2023)

414

(doi: 10.1021/acsaem.3c02223)

Machine Learning Uncovers Natural Product Modulators of the 5‑Lipoxygenase Pathway and Facilitates the Elucidation of Their Biological Mechanisms

S Mikutis, S Lawrinowitz, C Kretzer, L Dunsmore, L Sketeris, T Rodrigues, O Werz, GJL Bernardes

ACS chemical biology

(2023)

217

(doi: 10.1021/acschembio.3c00725)

Innenrücktitelbild: Unlocking a Dual‐Channel Pathway in CO2 Hydrogenation to Methanol over Single‐Site Zirconium on Amorphous Silica (Angew. Chem. 4/2024)

M Yang, J Yu, A Zimina, BB Sarma, J Grunwaldt, H Zada, L Wang, J Sun

Angewandte Chemie

(2023)

136

e202319538

(doi: 10.1002/ange.202319538)

Nanocluster Surface Microenvironment Modulates Electrocatalytic CO₂ Reduction.

S Yoo, S Yoo, G Deng, F Sun, K Lee, H Jang, CW Lee, X Liu, J Jang, Q Tang, YJ Hwang, T Hyeon, MS Bootharaju

Advanced Materials

(2023)

e2313032

(doi: 10.1002/adma.202313032)

Inside Back Cover: Unlocking a Dual‐Channel Pathway in CO₂ Hydrogenation to Methanol over Single‐Site Zirconium on Amorphous Silica (Angew. Chem. Int. Ed. 4/2024)

M Yang, J Yu, A Zimina, BB Sarma, J Grunwaldt, H Zada, L Wang, J Sun

Angewandte Chemie International Edition

(2023)

e202319538

(doi: 10.1002/anie.202319538)

Recyclable Conjugated Polyelectrolyte Hydrogels for Pseudocapacitor Fabrication

Y Jiang, RJ Vázquez, SR McCuskey, BRP Yip, G Quek, D Ohayon, B Kundukad, X Wang, GC Bazan

ACS Applied Materials & Interfaces

(2023)

19968

(doi: 10.1021/acsami.3c13137)

Heterogeneous nucleation in the random field Ising model