Publications

155 results for Mathias Steiner

Quantum Computer-Enhanced Surface Reaction Simulations for Battery Materials through Sample-Based Quantum Diagonalization and Local Embedding
- - Marco Antonio Guimaraes Auad Barroca
  - Rodrigo Neumann Barros Ferreira
  - et al.
- 2025
- APS Global Physics Summit 2025
Talk
Computing bandgaps of periodic materials with a quantum processor via tight-biding projection and subspace quantum diagonalization
- - Alan Duriez
  - Pamela Costa Carvalho
  - et al.
- 2025
- APS Global Physics Summit 2025
Talk
AI enabled, mobile soil pH classification with colorimetric paper sensors for sustainable agriculture
- - Ademir Ferreira da Silva
  - Ricardo Luis Ohta
  - et al.
- 2025
- PLoS ONE
Paper
Automated, LLM enabled extraction of synthesis details for reticular materials from scientific literature
- - Viviane T. Silva
  - Alexandre Rademaker
  - et al.
- 2024
- NeurIPS 2024
Workshop paper
Observing structural changes induced by gas adsorption in COF-300 with micro-Raman Spectroscopy
- - Geisa Lima
  - Matheus Esteves Ferreira
  - et al.
- 2024
- Enbraer 2024
Poster
Ab-initio Raman simulations of metal-organic-frameworks
- - Pamela Costa Carvalho
  - Felipe Lopes Oliveira
  - et al.
- 2024
- Enbraer 2024
Poster
In situ characterization of CO2 adsorption in metal organic frameworks
- - Matheus Esteves Ferreira
  - Geisa Lima
  - et al.
- 2024
- Enbraer 2024
Poster
Quantum-centric supercomputing for materials science: A perspective on challenges and future directions
- - Yuri Alexeev
  - Maximilian Amsler
  - et al.
- 2024
- Future Generation Computer Systems
Paper
Exploring qubit-ADAPT-VQE for materials discovery in direct air capture
- - Marco Antonio Guimaraes Auad Barroca
  - Rodrigo Neumann Barros Ferreira
  - et al.
- 2024
- Apl Quantum
Paper
pyMSER─An Open-Source Library for Automatic Equilibration Detection in Molecular Simulations
- - Felipe L. Oliveira
  - Binquan Luan
  - et al.
- 2024
- JCTC
Paper