Publications

3553 results for Materials Discovery

Quantile-Frequency Analysis and Deep Learning for Signal Classification
- - Ta-Hsin Li
- 2023
- Journal of Nondestructive Evaluation
Paper
CRAFTED - An exploratory database of simulated adsorption isotherms of metal-organic frameworks
- - Felipe Lopes de Oliveira
  - Conor Cleeton
  - et al.
- 2023
- Scientific Data
Paper
Molecular rotations, multi-scale order, hyperuniformity and signatures of metastability during the compression/decompression cycles of amorphous ices.
- - Maud Formanek
  - Salvatore Torquato
  - et al.
- 2023
- The Journal of Physical Chemistry B
Paper
Human-AI Co-Creation Approach to Find Forever Chemicals Replacements
- - Juliana Jansen Ferreira
  - Vinicius Segura
  - et al.
- 2023
- CHI 2023
Workshop paper
Opportunities of topological semimetals as novel material for computing. Experimental transport studies and devices
- - Heinz Schmid
  - Alan Molinari
  - et al.
- 2023
- MRS Spring Meeting 2023
Invited talk
Materials Design of OTS Selectors and Phase-Change Materials for 3D Cross-point Memory Technology
- - Michelle Cheng
  - Wei-Chih Chien
  - et al.
- 2023
- MRS Spring Meeting 2023
Invited talk
Machine-Learning Potentials for Molecular Dynamics Simulations of CO² Chemisorption and Diffusion in Mg-MOF-74
- - Binquan Luan
  - Bowen Zheng
  - et al.
- 2023
- MRS Spring Meeting 2023
Talk
Improving VO₂ Granular Films’ CMOS Compatibility to Perform Oscillation-Based Computing
- - Olivier Maher
  - Nele Harnack
  - et al.
- 2023
- MRS Spring Meeting 2023
Talk
Quantum Chemical Data Generation as Fill-In for Reliability Enhancement of Machine-Learning Reaction and Retrosynthesis Planning
- - Alessandra Toniato
  - Jan Unsleber
  - et al.
- 2023
- MRS Spring Meeting 2023
Talk
Cost-Sensitive Bayesian Active Molecular Design with Auxiliary Properties
- - Elliot Nelson
  - Dmitry Zubarev
- 2023
- MRS Spring Meeting 2023
Talk