Amber Mace
Biträdande universitetslektor vid Institutionen för kemi - Ångström; Strukturkemi
- E-post:
- amber.mace@kemi.uu.se
- Besöksadress:
- Lägerhyddsvägen 1
- Postadress:
- Box 538
751 21 Uppsala
Ladda ned kontaktuppgifter för Amber Mace vid Institutionen för kemi - Ångström; Strukturkemi
Kort presentation
Researcher in Computational Materials Chemistry
Research interests:
- Multiscale modeling and method development of diffusion models
- Design of High-throughput screening studies
- Ion diffusion in Li-ion battery materials
- Guest particle interactions and kinetics in nano-porous materials
- Topological analysis of energetic space
Publications: https://scholar.google.com/citations?user=uvsPp_8AAAAJ&hl=sv
TEOROO/CMC group webpage: http://www.teoroo.kemi.uu.se/
Nyckelord
- modeling and simulation
- molecular modelling
- theoretical chemistry
- computational chemistry
- li-ion batteries
- ion diffusion
- materials modelling
- multiscale modeling
Biografi
Anställning:
- 2021- Bitr. universitetslektor, Uppsala universitet
- 2019-2021 Forskare, Uppsala universitet
- 2016-2019 Postdok, École Polytechnique Fédérale de Lausanne, Schweiz
- 2010-2015 Doktorand, Institutionen för Material och Miljökemi, Stockholms Universitet
Utbildning:
- 2015 Fil. Dr. Fysikalisk Kemi, Stockholms Universitet
- 2010 Fil. Mag. Fysik, Stockholms Universitet
Akademiska meriter:
- 2023 Docent
Forskningsanslag:
- 2020-2023 Etableringsbidrag, Vetenskapsrådet
- 2020-2024 Projektanslag, Energimyndigheten (medsökande)
- 2016-2019 Internationell Postdok, Vetenskapsrådet
Publikationer
Senaste publikationer
Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
Ingår i Journal of Chemical Theory and Computation, s. 18-29, 2024
- DOI för Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
- Ladda ner fulltext (pdf) av Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
Ingår i Physical Chemistry, Chemical Physics - PCCP, s. 6216-6227, 2024
- DOI för The sensitive aspects of modelling polymer-ceramic composite solid-state electrolytes using molecular dynamics simulations
- Ladda ner fulltext (pdf) av The sensitive aspects of modelling polymer-ceramic composite solid-state electrolytes using molecular dynamics simulations
Ingår i Chemistry of Materials, s. 11359-11376, 2024
- DOI för Understanding Mobile Particles in Solid-State Materials: From the Perspective of Potential Energy Surfaces
- Ladda ner fulltext (pdf) av Understanding Mobile Particles in Solid-State Materials: From the Perspective of Potential Energy Surfaces
Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
Ingår i Crystals, 2022
- DOI för Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
- Ladda ner fulltext (pdf) av Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
Pressure-induced amorphization of noble gas clathrate hydrates
Ingår i Physical Review B, 2021
- DOI för Pressure-induced amorphization of noble gas clathrate hydrates
- Ladda ner fulltext (pdf) av Pressure-induced amorphization of noble gas clathrate hydrates
Alla publikationer
Artiklar i tidskrift
Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
Ingår i Journal of Chemical Theory and Computation, s. 18-29, 2024
- DOI för Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
- Ladda ner fulltext (pdf) av Predicting Ion Diffusion from the Shape of Potential Energy Landscapes
Ingår i Physical Chemistry, Chemical Physics - PCCP, s. 6216-6227, 2024
- DOI för The sensitive aspects of modelling polymer-ceramic composite solid-state electrolytes using molecular dynamics simulations
- Ladda ner fulltext (pdf) av The sensitive aspects of modelling polymer-ceramic composite solid-state electrolytes using molecular dynamics simulations
Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
Ingår i Crystals, 2022
- DOI för Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
- Ladda ner fulltext (pdf) av Exploring High-Pressure Transformations in Low-Z (H2, Ne) Hydrates at Low Temperatures
Pressure-induced amorphization of noble gas clathrate hydrates
Ingår i Physical Review B, 2021
- DOI för Pressure-induced amorphization of noble gas clathrate hydrates
- Ladda ner fulltext (pdf) av Pressure-induced amorphization of noble gas clathrate hydrates
Ingår i ACS Applied Materials and Interfaces, s. 57118-57131, 2021
- DOI för Toward Optimal Photocatalytic Hydrogen Generation from Water Using Pyrene-Based Metal-Organic Frameworks
- Ladda ner fulltext (pdf) av Toward Optimal Photocatalytic Hydrogen Generation from Water Using Pyrene-Based Metal-Organic Frameworks
Polyketones as Host Materials for Solid Polymer Electrolytes
Ingår i Journal of the Electrochemical Society, 2020
- DOI för Polyketones as Host Materials for Solid Polymer Electrolytes
- Ladda ner fulltext (pdf) av Polyketones as Host Materials for Solid Polymer Electrolytes
Adsorption kinetics for CO 2 on highly selective zeolites NaKA and nano-NaKA
Ingår i Applied Energy, s. 1326-1336, 2013
Artiklar, forskningsöversikt
Ingår i Chemistry of Materials, s. 11359-11376, 2024
- DOI för Understanding Mobile Particles in Solid-State Materials: From the Perspective of Potential Energy Surfaces
- Ladda ner fulltext (pdf) av Understanding Mobile Particles in Solid-State Materials: From the Perspective of Potential Energy Surfaces