设为首页
收藏本站
网站地图
|
English
|
公务邮箱
About the library
Background
History
Leadership
Organization
Readers' Guide
Opening Hours
Collections
Help Via Email
Publications
Electronic Information Resources
常用资源
电子图书
期刊论文
学位会议
外文资源
特色专题
内部出版物
Wiley电子期刊(3)
NATURE电子期刊(1)
ACS电子期刊(28)
SpringerLink电子期刊(21)
Elsevier电子期刊(22)
在“
ACS电子期刊
”中,
命中:
28
条,耗时:小于0.01 秒
在所有数据库中总计命中:
75
条
1.
Vibronic Coupling Explains the Different Shape of Electronic Circular Dichroism and of Circularly Polarized Luminescence Spectra of Hexahelicenes
作者:
Yanli Liu
;
Javier Cerezo
;
Giuseppe Mazzeo
;
Na Lin
;
Xian Zhao
;
Giovanna Longhi
;
Sergio Abbate
;
Fabrizio
Santoro
刊名:Journal of Chemical Theory and Computation
出版年:2016
2.
Quantum Mechanical Studies on the Photophysics and the Photochemistry of Nucleic Acids and Nucleobases
作者:
Roberto Improta
;
Fabrizio
Santoro
;
Lluís Blancafort
刊名:Chemical Reviews
出版年:2016
3.
Quantum-Classical Calculation of Vibronic Spectra along a Reaction Path: The Case of the ECD of Easily Interconvertible Conformers with Opposite Chiral Responses
作者:
Javier Cerezo
;
Giuseppe Mazzeo
;
Giovanna Longhi
;
Sergio Abbate
;
Fabrizio
Santoro
刊名:The Journal of Physical Chemistry Letters
出版年:2016
4.
Revisiting Vertical Models To Simulate the Line Shape of Electronic Spectra Adopting Cartesian and Internal Coordinates
作者:
Javier Cerezo
;
Fabrizio
Santoro
刊名:Journal of Chemical Theory and Computation
出版年:2016
5.
Modeling Solvent Broadening on the Vibronic Spectra of a Series of Coumarin Dyes. From Implicit to Explicit Solvent Models
作者:
Javier Cerezo
;
Francisco J. Avila Ferrer
;
Giacomo Prampolini
;
Fabrizio
Santoro
刊名:Journal of Chemical Theory and Computation
出版年:2015
6.
Absorption and Emission Spectral Shapes of a Prototype Dye in Water by Combining Classical/Dynamical and Quantum/Static Approaches
作者:
Alessio Petrone
;
Javier Cerezo
;
Francisco J. Avila Ferrer
;
Greta Donati
;
Roberto Improta
;
Nadia Rega
;
Fabrizio
Santoro
刊名:Journal of Physical Chemistry A
出版年:2015
7.
TD-DFT Investigation of the Magnetic Circular Dichroism Spectra of Some Purine and Pyrimidine Bases of Nucleic Acids
作者:
Tobias Fahleson
;
Joanna Kauczor
;
Patrick Norman
;
Fabrizio
Santoro
;
Roberto Improta
;
Sonia Coriani
刊名:Journal of Physical Chemistry A
出版年:2015
8.
Relative Stability of the La and Lb Excited States in Adenine and Guanine: Direct Evidence from TD-DFT Calculations of MCD Spectra
作者:
Fabrizio
Santoro
;
Roberto Improta
;
Tobias Fahleson
;
Joanna Kauczor
;
Patrick Norman
;
Sonia Coriani
刊名:The Journal of Physical Chemistry Letters
出版年:2014
9.
Combination of Transient 2D-IR Experiments and Ab Initio Computations Sheds Light on the Formation of the Charge-Transfer State in Photoexcited Carbonyl Carotenoids
作者:
Mariangela Di Donato
;
Mireia Segado Centellas
;
Andrea Lapini
;
Manuela Lima
;
Francisco Avila
;
Fabrizio
Santoro
;
Chiara Cappelli
;
Roberto Righini
刊名:Journal of Physical Chemistry B
出版年:2014
10.
Optical Properties of Diarylethenes with TD-DFT: 0鈥? Energies, Fluorescence, Stokes Shifts, and Vibronic Shapes
作者:
Agisilaos Chantzis
;
Javier Cerezo
;
Aur茅lie Perrier
;
Fabrizio
Santoro
;
Denis Jacquemin
刊名:Journal of Chemical Theory and Computation
出版年:2014
1
2
3
按检索点细分(28)
题名(28)
按出版年细分(28)
2016年(4)
2015年(3)
2014年(4)
2013年(6)
2011年(2)
2010年(1)
2009年(3)
2008年(3)
2007年(1)
2006年(1)
NGLC 2004-2010.National Geological Library of China All Rights Reserved.
Add:29 Xueyuan Rd,Haidian District,Beijing,PRC. Mail Add: 8324 mailbox 100083
For exchange or info please contact us via
email
.