Stephen G. Dale - Publications, H-index & Citations

Stephen G. Dale

National University of Singapore

16H指数

46论文数

963被引数

收录论文 14

发表时间

Constructing high-ionic-conductivity solid-state electrolytes with improved interface stability by rapid laser processing 通过快速激光处理构建具有高离子电导率和改进界面稳定性的固态电解质

Journal of Energy Chemistry

IF14.9

2025-07-05

PREAI

Yuqing Liu; Stephen G. Dale; Chorng Haur Sow; Puneet Gupta; Sharon Xiaodai Lim

Diagonalization without Diagonalization: A Direct Optimization Approach for Solid-State Density Functional Theory 对角化方法的对角化：一种用于固态密度泛函理论的直接优化方法

JOURNAL OF CHEMICAL THEORY AND COMPUTATION

IF5.5

2025-04-28

OAAI

Li, Tianbo; Lin, Min; Dale, Stephen G.; Shi, Zekun; Neto, A. H. Castro; Novoselov, Kostya S.; Vignale, Giovanni

Identifying and embedding transferability in data-driven representations of chemical space 在化学空间的数据驱动表示中识别和嵌入可转移性

CHEMICAL SCIENCE

IF7.4

2024-01-01

OAAI

Gould, Tim; Chan, Bun; Dale, Stephen G.; Vuckovic, Stefan

Introducing Novel Materials with Diffuse Electrons for Applications in Redox Catalysis and Quantum Computing via Theoretical Calculations

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2023-05-09

PREAI

Jackson, Benjamin A.; Dale, Stephen G.; Camarasa-Gomez, Maria; Miliordos, Evangelos

Delocalization error: The greatest outstanding challenge in density-functional theory

WILEY INTERDISCIPLINARY REVIEWS-COMPUTATIONAL MOLECULAR SCIENCE

IF27

2022-07-01

PREAI

Bryenton, Kyle R.; Adeleke, Adebayo A.; Dale, Stephen G.; Johnson, Erin R.

Linear fractional charge behavior in density functional theory through dielectric tuning of conductor-like polarizable continuum model

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2022-01-06

OAAI

Hemmingsen, Luke O.; Hervir, Oliver A. J.; Dale, Stephen G.

Quantum Chemical Methods for Modeling Covalent Modification of Biological Thiols

JOURNAL OF COMPUTATIONAL CHEMISTRY

IF4.8

2019-09-11

OAAI

Awoonor-Williams, Ernest; Isley, William C.; Dale, Stephen G.; Johnson, Erin R.; Yu, Haibo; Becke, Axel D.; Roux, Benoit; Rowley, Christopher N.

Pervasive Delocalisation Error Causes Spurious Proton Transfer in Organic Acid-Base Co-Crystals

ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

IF16.9

2018-10-09

OAAI

LeBlanc, Luc M.; Dale, Stephen G.; Taylor, Christopher R.; Becke, Axel D.; Day, Graeme M.; Johnson, Erin R.

Communication: Correct charge transfer in CT complexes from the Becke'05 density functional

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2018-06-06

OAAI

Becke, Axel D.; Dale, Stephen G.; Johnson, Erin R.

Pressure-Induced Isostructural Antiferromagnetic-Ferromagnetic Transition in an Organic Electride

JOURNAL OF PHYSICAL CHEMISTRY C

IF3.2

2018-05-30

OAAI

Dale, Stephen G.; Otero-de-la-Roza, A.; Johnson, Erin R.

Interrogating the Becke'05 density functional for non-locality information

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2017-10-19

PREAI

Dale, Stephen G.; Johnson, Erin R.; Becke, Axel D.

Counterintuitive electron localisation from density-functional theory with polarisable solvent models

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2015-11-12

PREAI

Dale, Stephen G.; Johnson, Erin R.

Efficient basis sets for non-covalent interactions in XDM-corrected density-functional theory

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-12-04

PREAI

Johnson, Erin R.; Otero-de-la-Roza, Alberto; Dale, Stephen G.; DiLabio, Gino A.

Extreme density-driven delocalization error for a model solvated-electron system

JOURNAL OF CHEMICAL PHYSICS

IF3.1

2013-11-14

110

PREAI

Johnson, Erin R.; Otero-de-la-Roza, A.; Dale, Stephen G.

研究方向