Inverse design in search of materials with target functionalities

2018/03/29 by Alex Zunger · 5 citations
Materials Science · #Electronic and Structural Properties of Oxides #Machine Learning in Materials Science #Quantum Dots Synthesis And Properties

paper · doi:10.1038/s41570-018-0121

crossref issued 2018/03/29 · crossref published 2018/03/29 · crossref published-online 2018/03/29 · openalex publication_date 2018/03/29 · crossref created 2018/03/29 · crossref deposited 2022/12/21 · openalex created_date 2025/10/10 · openalex updated_date 2026/07/31 · crossref indexed 2026/08/05

Citations

• First-Principles Theory of Competing Order Types, Phase Separation, and Phonon Spectra in ThermoelectricAgPbmSbTem+2Alloys
• Quantum Spin Hall Insulator State in HgTe Quantum Wells
• Momentum-space formalism for the total energy of solids
• Observation of Majorana Fermions in Ferromagnetic Atomic Chains on a Superconductor

Cited by

• Physics-Informed Tree Search for High-Dimensional Computational Design
• The Rashba Scale: Emergence of Band Anti-crossing as a Design Principle for Materials with Large Rashba Coefficient
• Language Models for Materials Discovery and Sustainability: Progress, Challenges, and Opportunities
• Chemistry of Quantum Spin Liquids
• Alex Zunger [wikipedia]