Amber Mace

Short presentation

I am an Assistant Professor in computational materials chemistry leading a research team which a main focus on investigating how ions and molecules interact and move through materials, with applications in batteries and nanoporous systems.

We develop computational methods to connect atomic-scale interactions with diffusion across longer length and time scales. A particular focus is how the shape and connectivity of potential energy landscapes influence particle transport.

Keywords

  • modeling and simulation
  • molecular modelling
  • theoretical chemistry
  • computational chemistry
  • li-ion batteries
  • ion diffusion
  • materials modelling
  • multiscale modeling

Biography

Employment:

  • 2021- Assist. Professor, Uppsala university
  • 2019- Researcher, Uppsala universitet
  • 2016-2019 Postdoctoral researcher, École Polytechnique Fédérale de Lausanne, Switzerland
  • 2010-2015 PhD student, Department of Materials and Environmental Chemistry, Stockholm University

Education:

  • 2015 PhD in Physical Chemistry, Stockholm University
  • 2010 MSc in Physics, Stockholm University

Major Research Grants:

  • 2026-2029 Project grant, Swedish Energy Agency
  • 2026-2029 Project grant, Swedish research council (VR)
  • 2020-2024 Starting grant, Swedish research council (VR)
  • 2016-2019 International Postdoc grant, Swedish research council (VR)

Research

My research interests include:

  • Multiscale modelling of diffusion and particle transport
  • Ion diffusion in battery materials
  • Molecular interactions and transport in nanoporous materials
  • High-throughput computational screening
  • Topological analysis of potential energy landscapes

My current research team:

Amber Mace

Publications

Selection of publications

Recent publications

All publications

Articles in journal

Articles, review/survey

Conference papers