Kungl. Tekniska Högskolan Royal Institute of Technology
School of Biotechnology
Division of
Theoretical Chemistry
& Biology
Top Illustration
 Home | Contact | People | Research | Publications | Internal docs | Education | Links | Networks Site map

List of PhD theses

PhD theses from our group can be found on this page: >> link to list of PhD theses >>

List of publications

Field
Section
Sub-section
and or Search

The publications are currently ordered by title, yearwise. Click on the publication title to get more information about it.


1. Stable High-Energy Density Super-Atom Clusters of Aluminum Hydride
K.Y. Lian, Y.F. Jiang, D.H. Fei, W. Feng, M.X. Jin, D.J. Ding and Y. Luo ,
Chin. J. Chem. Phys., 25 (2012) 147
 

2. Molecular Polarization Bridging Physical and Chemical Enhancements in Surface Enhanced Raman Scattering
S. Duan, X. Xu, Y. Luo and Z.Q. Tian
Chem. Comm. 47 (2011) 11438
 

3. Theoretical Study of Vibration Spectra of Sensitizing Dyes for Photoelectrical Converters Based on Ruthenium(II) and Iridium(III) Complexes
B.F. Minaev, V.A. Minaeva, G.V. Baryshnikov, M A. Girtu and H. Ågren
Russian Journal of Applied Chemistry, 2009, 82, 1211 DOI: 10.1134/S1070427209070106

4. Dynamic properties and optical phase conjugation of two-photon pumped and ultrashort blue stimulated emission in a chromophore solution
G.S. He, H.Y. Qin, Q. Zheng, P.N. Prasad, S. Jockusch, N.J. Turro, M. Halim, D. Sames, H. Ågren and S. He
Phys. Rev. A 77, 013824 (2008)
 

5. Stimulated Rayleigh-Bragg Scattering From a Two-Photon Absorbing CdSe/Cds/ZnS Quantum-Rods System: Optical Limiting and Phase-Conjugation
G.S. He, K.T. Yong, H.Y Qin, Q. Zheng, P.N. Prasad, S. He and H. Ågren
IEEE J. of Quantum Electronics, 44, 894 (2008)
 

6. Three-branched dendritic NLOphores, more than three times a single-strand chromophore?
J. Holtmann, E. Walczuk, M. Dede, C. Wittenburg, J. Heck, G. Archetti, R. Wortmann, H.-G. Kuball, Y.-H. Wang, K. Liu and Y. Luo
J. Phys. Chem. B 112 (2008) 14751
 

7. Electric Field Poled Polymeric Nonlinear Optical Systems: Molecular Dynamics Simulations of Poly(Methyl Methacrylate) Doped with Disperse Red Chromophores
Y. Tu, Q. Zhang and H. Ågren
J. Phys. Chem. B 111, 3591 (2007)
 

8. Electronic states and phosphorescence of dendron functionalized platinum(II) acetylides
M. Lindgren, B. Minaev, E. Glimsdal, R. Vestberg, R. Westlund and E. Malmstroem
Journal of Luminescence, 124, 302-310 (2007)
 

9. Excited states and two-photon absorption of some novel thiophenyl Pt(II)-ethynyl derivatives
E. Glimsdal, M. Carlsson, B. Eliassson, B. Minaev and M. Lindgren.
J. Phys. Chem. A, 111, 244-250 (2007)
 

10. Molecular Dynamics Simulation of Local Field Factors
Q. Zhang, Y. Tu, H. Tian and H. Ågren
J. Chem. Phys., 127, 014501(2007)
 

11. Molecular Dynamics Simulations of Polycarbonate Doped with Lemke Chromophores
Q. Zhang, Y. Tu, H. Tian and H. Å gren
J. Phys. Chem. B, 111, 10645 (2007)
 

12. On mechanisms of enhanced fluorescence in green fluorescent proteins
E.B. Starikov, I. Panas, Y. Mochizuki, S. Tanaka, Y. Luo and H. Ågren
Biophysical Reviews and Letters, 2, 221 (2007)
 

13. Modeling of Non-linear Optic Properties of Guest-Host Systems
H. Ågren and Y. Tu
Nonlinear Optics and Quantum Optics, \bf 35, No 1-3. (2006)
 

14. Molecular dynamics simulations applied to electric field induced second harmonic generation in dipolar chromophore solutions
Y. Tu, Y. Luo and H. Ågren
J. Phys. Chem. B \bf 110, 8971 (2006)
 

15. Angular anisotropy of delay time of short pulses in impurity band based photonic crystals
V. Kimberg, F. Gel'mukhanov and H. Ågren
J. Opt. A.: Pure Appl.Opt. 7, 118-122 (2005)
 

16. Can octupolar molecules be poled by an external electric field?
Y. Tu, Y. Luo and H. Ågren
J. Phys. Chem. B \bf 109,16730 (2005)
 

17. Modeling non-linear optical effects in guest-host systems
H. Ågren, Y. Tu and Y. Luo
Chin. Opt. Lett. 3, 17 (2005)
 

18. Polarizability of silicon clusters
Y. Mochizuki and H.Ågren
Chem. Phys. Letters, 336, 451 (2001).
 

19. Nonlinear optical susceptibilities of fullerenes in the condensed phase
Y.Luo, P.Norman, P.Macak and H.Ågren
Phys. Rev. B 61, 3060 (2000)
Attached: PRB03060.pdf

20. Nonlinear optical processes of spiroconjugated dimers
Y. Luo, P. Norman and H. Ågren
Chem. Phys. Letters \bf 303, 616 (1999)
 

21. Molecular length dependence of optical properties in hydrocarbon oligomers
Y. Luo, P. Norman, K. Ruud and H. Ågren
Chem. Phys. Letters 285,160 (1998)
 

22. Nonlinear optical properties of multi-dimensional charge transfer functional groups in ferroelectric liquid crystals
Y. Luo, M. Lindgren and H. Ågren
Optical Materials 9, 216 (1998)
 

23. On the scaling law of the second static hyperpolarizabilities of fullerenes
Y. Luo
Chem. Phys. Lett. 289 (1998) 350.
 

24. Saturation of optical band gap and properties of five-membered heteroaromatic oligomers
Y. Luo, K. Ruud, P. Norman, D. Jonsson and H. Ågren
J. Phys. Chem. \bf 102, 1710 (1998)
 

25. The Cotton-Mouton effect of liquid water. Part II: The semi-continuum model.
K. Ruud, H. Ågren, P. Dahle, T. Helgaker, A. Rizzo, S. Coriani, H. Koch, K. Sylvester-Hvid and K.V. Mikkelsen
J.Chem.Phys. \bf 108, 599 (1998)
 

26. The electric and magnetic properties of fullerenes
D. Jonsson, P. Norman, K. Ruud, H. Ågren and T. Helgaker
J. Chem. Phys. \bf 109, 572 (1998)
 

27. The Hartree-Fock limit magnetizability of C60
K. Ruud, H. Ågren, T. Helgaker, P. Dahle, H. Koch and P.R. Taylor
Chem. Phys. Lett. \bf 285, 205 (1998)
 

28. Ab initio calculations of the polarizability and the hyperpolarizability of C60
P. Norman, Y. Luo, D. Jonsson and H. Ågren
J. Chem. Phys. \bf 106, 8788 (1997)
 

29. Ground and excited states hyperpolarizabilities of cis-, trans- and diphenyl- polyenes
Y. Luo, P. Norman, D. Jonsson and H. Ågren
Mol. Phys. \bf 89, 1409 (1996)
 

30. The hyperpolarizability of the tricyanomethanide ion in solution
Y. Luo, A. Cesar and H. Ågren
Chem. Phys. Letters 252, 384 ( Erratum 257, 681 ) (1996)
 

31. Random-phase calculations of frequency dependent polarizabilities and hyperpolarizabilities of long polyene chains
Y. Luo, H. Ågren, H. Koch, P. Jørgensen and T. Helgaker
Phys. Rev. B \bf 51, 14949 (1995)
 

32. Sign change of the hyperpolarizabilities of solvated water
K. V. Mikkelsen, Y. Luo, H. Ågren and P. Jørgensen
J. Chem. Phys. \bf 102, 9362 (1995)
 


Search the database


replace backslash in the latex representations by underscore; example: when searching for {\\AA}gren, type {_AA}gren in the Author field. One can type national characters directly, too.
Title:
Author:
Keywords:
Year:

Add new publication