29 Si NMR Shielding Calculations Employing Density Functional Theory, Focussing on Hypervalent Silicon Compounds
Author:
Affiliation:
1. Institute of Materials Chemistry, Vienna University of Technology Getreidemarkt 9, 1060 Vienna, Austria
2. Institute of Applied Synthetic Chemistry, Vienna University of Technology Getreidemarkt 9, 1060 Vienna, Austria
Publisher
Wiley
Subject
Inorganic Chemistry
Link
https://onlinelibrary.wiley.com/doi/pdf/10.1002/ejic.201100286
Reference64 articles.
1. The DFT route to NMR chemical shifts
2. Magnetic Shielding of Nuclei in Molecules
3. Efficient implementation of the gauge-independent atomic orbital method for NMR chemical shift calculations
4. Calculation of NMR Shielding Tensors Using Gauge-Including Atomic Orbitals and Modern Density Functional Theory
Cited by 14 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. Phosphine‐Catalyzed Activation of Phenylsilane for Benzaldehyde Reduction;ChemPlusChem;2023-03-21
2. Identifying the meta, para and ortho isomers in octa(aminophenyl)silsesquioxane (OAPS) from joint experimental characterizations and theoretical predictions of the IR and NMR spectra;Journal of Molecular Structure;2022-10
3. Comprehensive Benchmark Study on the Calculation of 29Si NMR Chemical Shifts;Inorganic Chemistry;2020-12-15
4. Benchmarking DFT Calculations of 1 H and 13 C Chemical Shifts in Monosubstituted Ferrocenes;International Journal of Quantum Chemistry;2020-09-09
5. An Uncommon Hypervalent Fluorooxosilicophosphate;Chemistry – An Asian Journal;2019-11-28
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