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Materials Science

Working Paper

Strain Induced Tunability of the Electronic Properties of SrTiO3 Interfaces

Zhenyun Lan, Tejs Vegge, Ivano E. Castelli

Version 1 posted 20 November 2019

603

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Theoretical and Computational Chemistry

Working Paper

Computational Framework for a Systematic Investigation of Anionic Redox Process in Li-Rich Compounds

Alexander Tygesen, Jinhyun Chang, Tejs Vegge, Juan Maria García Lastra

Version 1 posted 20 November 2019

768

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Theoretical and Computational Chemistry

Working Paper

Rapid mapping of alloy surface phase diagrams via Bayesian evolutionary multitasking

Shuang Han, Steen Lysgaard, Tejs Vegge, Heine Anton Hansen

Version 4 posted 28 April 2023

766

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Analytical Chemistry

Working Paper

Understanding the patterns that neural networks learn from chemical spectra

Laura Hannemose Rieger, Max Wilson, Tejs Vegge, Eibar Flores

Version 1 posted 14 March 2023

327

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Energy

Working Paper

Phase-field investigation of lithium electrodeposition under different applied overpotentials and operating temperatures

Joonyeob Jeon, Gil Ho Yoon, Tejs Vegge, Jin Hyun Chang

Version 1 posted 22 December 2021

388

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Energy

Working Paper

Sensitivity analysis methodology for battery degradation models

Williams Agyei Appiah, Jonas Busk, Tejs Vegge, Arghya Bhowmik

Version 2 posted 11 August 2022

332

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Catalysis

Working Paper

Low-temperature ammonia synthesis on electron-rich [RuH6] catalytic centers

Jaysree Pan, Qianru Wang, Jianping Guo, Heine Anton Hansen, Ping Chen, Tejs Vegge

Version 1 posted 17 September 2021

364

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Theoretical and Computational Chemistry

Working Paper

Large dataset of molecular and reaction energies from multi-level quantum chemical methods

Surajit Nandi, Tejs Vegge, Arghya Bhowmik

Version 2 posted 09 September 2022

739

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Physical Chemistry

Working Paper

PRISMA: A robust and intuitive tool for high-throughput processing of chemical spectra

Eibar Flores, Nataliia Mozhzhukhina, Xinyu Li, Poul Norby, Aleksandar Matic, Tejs Vegge

Version 2 posted 06 October 2021

524

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Theoretical and Computational Chemistry

Working Paper

Cheap turns superior: A linear regression-based correction method to reaction energy from DFT

Surajit Nandi, Jonas Busk, Peter Bjørn Jørgensen, Tejs Vegge, Arghya Bhowmik

Version 1 posted 15 June 2022

361

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Refine Search

27 results in Tejs Vegge in Authors: Tejs Vegge

Strain Induced Tunability of the Electronic Properties of SrTiO3 Interfaces

Computational Framework for a Systematic Investigation of Anionic Redox Process in Li-Rich Compounds

Rapid mapping of alloy surface phase diagrams via Bayesian evolutionary multitasking

Understanding the patterns that neural networks learn from chemical spectra

Phase-field investigation of lithium electrodeposition under different applied overpotentials and operating temperatures

Sensitivity analysis methodology for battery degradation models

Low-temperature ammonia synthesis on electron-rich [RuH6] catalytic centers

Large dataset of molecular and reaction energies from multi-level quantum chemical methods

PRISMA: A robust and intuitive tool for high-throughput processing of chemical spectra

Cheap turns superior: A linear regression-based correction method to reaction energy from DFT

27 results in Authors: Tejs Vegge