基本信息
views: 39
![](https://originalfileserver.aminer.cn/sys/aminer/icon/show-trajectory.png)
Bio
Research:
Theoretical Chemistry: density functional theory
* Frozen-Density Embedding Theory
* subsystem formulation of density functional theory (ground state)
* subsystem formulation of density functional theory (excited states)
* density functional for the kinetic energy
Computational Chemistry: Computer Modelling and Simulations of polyatomic systems at quantum mechanical level
* multilevel modelling, * solvatochromism, * optical centers in solids, * IR, Raman and VCD spectra of organic molecules, * non-covalently bound intermolecular complexes, * guest molecules in porous solids, * enzymatic reactions,
Research Highlights
For more details, see my recent publications and/or talks.
Theoretical Chemistry: density functional theory
* Frozen-Density Embedding Theory
* subsystem formulation of density functional theory (ground state)
* subsystem formulation of density functional theory (excited states)
* density functional for the kinetic energy
Computational Chemistry: Computer Modelling and Simulations of polyatomic systems at quantum mechanical level
* multilevel modelling, * solvatochromism, * optical centers in solids, * IR, Raman and VCD spectra of organic molecules, * non-covalently bound intermolecular complexes, * guest molecules in porous solids, * enzymatic reactions,
Research Highlights
For more details, see my recent publications and/or talks.
Research Interests
Papers共 64 篇Author StatisticsCo-AuthorSimilar Experts
By YearBy Citation主题筛选期刊级别筛选合作者筛选合作机构筛选
时间
引用量
主题
期刊级别
合作者
合作机构
JOURNAL OF PHYSICAL CHEMISTRY Ano. 2 (2023): 535-545
JOURNAL OF CHEMICAL PHYSICSno. 8 (2022)
arXiv (Cornell University)no. 4 (2022)
International Journal of Quantum Chemistryno. 1 (2018): 25410
Cited0Views0Bibtex
0
0
Load More
Author Statistics
Co-Author
Co-Institution
D-Core
- 合作者
- 学生
- 导师
Data Disclaimer
The page data are from open Internet sources, cooperative publishers and automatic analysis results through AI technology. We do not make any commitments and guarantees for the validity, accuracy, correctness, reliability, completeness and timeliness of the page data. If you have any questions, please contact us by email: report@aminer.cn