Anharmonic Raman spectra simulation of crystals from deep neural networks
Author:
Affiliation:
1. State Key Laboratory of Computer Architecture, Institute of Computing Technology, Chinese Academy of Sciences, Beijing 100190, China
2. School of Electronic Science and Applied Physics, Hefei University of Technology, Hefei, Anhui 230009, China
Funder
National Natural Science Foundation of China
Publisher
AIP Publishing
Subject
General Physics and Astronomy
Link
https://aip.scitation.org/doi/pdf/10.1063/5.0040190
Reference32 articles.
1. Raman spectroscopy of proteins: a review
2. Using Raman spectroscopy to characterize biological materials
3. Raman and infrared active modes of aluminium phosphide
4. Ab initioanalytical Raman intensities for periodic systems through a coupled perturbed Hartree-Fock/Kohn-Sham method in an atomic orbital basis. I. Theory
5. First-principles responses of solids to atomic displacements and homogeneous electric fields: Implementation of a conjugate-gradient algorithm
Cited by 12 articles. 订阅此论文施引文献 订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献
1. Machine-learned interatomic potentials for transition metal dichalcogenide Mo1−xWxS2−2ySe2y alloys;npj Computational Materials;2024-08-03
2. Raman Spectra of Amino Acids and Peptides from Machine Learning Polarizabilities;Journal of Chemical Information and Modeling;2024-06-03
3. Deep-learning potential molecular dynamics simulations of the structural and physical properties of rare-earth metal scandium;Computational Materials Science;2024-06
4. Polarizability models for simulations of finite temperature Raman spectra from machine learning molecular dynamics;Physical Review Materials;2024-04-12
5. Delta Machine Learning for Predicting Dielectric Properties and Raman Spectra;The Journal of Physical Chemistry C;2024-04-03
1.学者识别学者识别
2.学术分析学术分析
3.人才评估人才评估
"同舟云学术"是以全球学者为主线，采集、加工和组织学术论文而形成的新型学术文献查询和分析系统，可以对全球学者进行文献检索和人才价值评估。用户可以通过关注某些学科领域的顶尖人物而持续追踪该领域的学科进展和研究前沿。经过近期的数据扩容，当前同舟云学术共收录了国内外主流学术期刊6万余种，收集的期刊论文及会议论文总量共计约1.5亿篇，并以每天添加12000余篇中外论文的速度递增。我们也可以为用户提供个性化、定制化的学者数据。欢迎来电咨询！咨询电话：010-8811{复制后删除}0370
www.globalauthorid.com
TOP
Copyright © 2019-2024 北京同舟云网络信息技术有限公司 京公网安备11010802033243号 京ICP备18003416号-3