Dr. Yang-hao Chan (Advanced Materials and Surface Science)
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Latest Research Work
Steven G. Louie, Yang-Hao Chan, Felipe H. da Jornada, Zhenglu Li, and Diana Y. Qiu
Nature Materials

Materials modelling and design using computational quantum and classical approaches is by now well established as an essen-tial pillar in condensed matter physics, chemistry and materials science research, in addition to experiments and analytical theories. The past few decades have witnessed tremendous advances in methodology development and applications to under-stand and predict the ground-state, excited-state and dynamical properties of materials, ranging from molecules to nanoscopic/mesoscopic materials to bulk and reduced-dimensional systems. This issue of Nature Materials presents four in-depth Review Articles on the field. This Perspective aims to give a brief overview of the progress, as well as provide some comments on future challenges and opportunities. We envision that increasingly powerful and versatile computational approaches, coupled with new conceptual understandings and the growth of techniques such as machine learning, will play a guiding role in the future search and discovery of materials for science and technology.
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Latest update 2025-04-30 14:15:19