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51

Band theory vs. Exciton theory interpretations of x-ray spectra of oligomers and polymers

Hans Ågren, Faris Gel'Mukhanov, Christoph Liegener

Journal:

International Journal of Quantum Chemistry

Year:

1997

Language:

english

File:

PDF, 405 KB

english, 1997

52

Spin uncoupling in ethylene activation by palladium and platinum atoms

Boris Minaev, Hans Ågren

Journal:

International Journal of Quantum Chemistry

Year:

1999

Language:

english

File:

PDF, 272 KB

english, 1999

53

Pure Organic Redox Couple for Quantum-Dot-Sensitized Solar Cells

Dr. Zhijun Ning, Dr. Haining Tian, Chunze Yuan, Dr. Ying Fu, Prof. Licheng Sun, Prof. Hans Ågren

Journal:

Chemistry - A European Journal

Year:

2011

Language:

english

File:

PDF, 313 KB

english, 2011

54

ChemInform Abstract: Resonant X-Ray Raman Scattering

Faris Gel'mukhanov, Hans Agren

Journal:

Year:

1999

File:

PDF, 24 KB

1999

55

ChemInform Abstract: Spin Uncoupling in Chemical Reactions

Boris F. Minaev, Hans Agren

Journal:

Year:

2001

File:

PDF, 23 KB

2001

56

Two-Photon Absorption Cross-Sections of Reference Dyes: A Critical Examination

Prakash Chandra Jha, Yanhua Wang, Hans Ågren

Journal:

Year:

2008

Language:

english

File:

PDF, 237 KB

english, 2008

57

Spin Multiplicity Dependence of Nonlinear Optical Properties

Prakash Chandra Jha, Zilvinas Rinkevicius, Hans Ågren

Journal:

Year:

2009

Language:

english

File:

PDF, 288 KB

english, 2009

58

Theoretical Studies on the Photoinduced Rearrangement Mechanism of α-Santonin

Dr. Xing Chen, Dr. Zilvinas Rinkevicius, Prof. Yi Luo, Prof. Hans Ågren, Prof. Zexing Cao

Journal:

Year:

2012

Language:

english

File:

PDF, 547 KB

english, 2012

59

Quantum Rod-Sensitized Solar Cells

Dr. Zhijun Ning, Chunze Yuan, Dr. Haining Tian, Dr. Peter Hedström, Prof. Licheng Sun, Prof. Hans Ågren

Journal:

Year:

2011

Language:

english

File:

PDF, 419 KB

english, 2011

60

Theoretical Study of Phosphorescence of Iridium Complexes with Fluorine-Substituted Phenylpyridine Ligands

Xin Li, Boris Minaev, Hans Ågren, He Tian

Journal:

European Journal of Inorganic Chemistry

Year:

2011

Language:

english

File:

PDF, 398 KB

english, 2011

61

Serum disposition of sertraline, N-desmethylsertraline and paroxetine: a pharmacokinetic evaluation of repeated drug concentration measurements during 6 months of treatment for major depression

Margareta Reis, Anna Åberg-Wistedt, Hans Ågren, Peter Höglund, Ann-Charlotte Åkerblad, Finn Bengtsson

Journal:

Human Psychopharmacology: Clinical and Experimental

Year:

2004

Language:

english

File:

PDF, 110 KB

english, 2004

62

Computational protocols for prediction of solute NMR relative chemical shifts. A case study of L-tryptophan in aqueous solution

Janus J. Eriksen, Jógvan Magnus H. Olsen, Kȩstutis Aidas, Hans Ågren, Kurt V. Mikkelsen, Jacob Kongsted

Journal:

Journal of Computational Chemistry

Year:

2011

Language:

english

File:

PDF, 683 KB

english, 2011

63

Many-electron contributions in the auger spectrum of CO

Hans Ågren, Hans Siegbahn

Journal:

Chemical Physics Letters

Year:

1980

Language:

english

File:

PDF, 488 KB

english, 1980

64

Semi-internal correlation in the auger electron spectrum of H2O

Hans Ågren, Hans Siegbahn

Journal:

Chemical Physics Letters

Year:

1980

Language:

english

File:

PDF, 474 KB

english, 1980

65

Application of the potential model for ESCA shifts to core-hole state geometric relaxation

Journal:

Chemical Physics Letters

Year:

1981

Language:

english

File:

PDF, 177 KB

english, 1981

66

Multiple excitations in the core photoelectron spectrum of acetylene

Reidar Arneberg, Hans Ågren, Per-Åke Malmquist, Svante Svensson

Journal:

Chemical Physics Letters

Year:

1982

Language:

english

File:

PDF, 412 KB

english, 1982

67

Multielectron transitions in the K-shell electron energy loss spectrum of N2

Reidar Arneberg, Hans Ågren, Jiri Müller, Rolf Manne

Journal:

Chemical Physics Letters

Year:

1982

Language:

english

File:

PDF, 377 KB

english, 1982

68

The lowest states of the O3+ ion

Per-Åke Malquist, Hans Ågren, Björn O. Roos

Journal:

Chemical Physics Letters

Year:

1983

Language:

english

File:

PDF, 439 KB

english, 1983

69

MC SCF optimization using the direct, restricted step, second-order norm-extended optimization method

Hans Jørgen Aa. Jensen, Hans Agren

Journal:

Chemical Physics Letters

Year:

1984

Language:

english

File:

PDF, 385 KB

english, 1984

70

On the constant resonance width approximation for core electron ionization

Hans Ågren, Amary Cesar, Vincenzo Carravetta

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 318 KB

english, 1987

71

An efficient method for the calculation of generalized overlap amplitudes for core photoelectron shake-up spectra

Hans Ågren, Hans Jørgen Aa. Jensen

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 492 KB

english, 1987

72

Discrete-continuum interaction for the core-hole state of water

Vincenzo Carravetta, Hans Ågren, Amary Cesar

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 433 KB

english, 1988

73

Static exchange and stieltjes imaging calculations; interpretation of a new high-resolution Cl 2p shake-up/shake-off spectrum of HCl

Vincenzo Carravetta, Hans Ågren, David Nordfors, Svante Svensson

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 496 KB

english, 1988

74

A note on the Renner splitting of the first ionized state of BeF2

Amary Cesar, Ming Bao Huang, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 477 KB

english, 1989

75

Is the core photoelectron band of neon asymmetric or not?

Vincenzo Carravetta, Hans Ågren, Amary Cesar

Journal:

Chemical Physics Letters

Year:

1991

Language:

english

File:

PDF, 582 KB

english, 1991

76

Frequency-dependent polarizabilities and second hyperpolarizabilities of N2

Yi Luo, Olav Vahtras, Hans Ågren, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 672 KB

english, 1993

77

Response theory calculations of the vibronically induced 1A1g−1B2u two-photon spectrum of benzene

Yi Luo, Hans Ågren, Sören Knuts, Boris F. Minaev, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 541 KB

english, 1993

78

The two-photon spectrum of pyrimidine. Role of vibronic coupling

Yi Luo, Hans Ågren, Sören Knuts, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 578 KB

english, 1993

79

The hyperpolarizability dispersion of para-nitroaniline

Yi Luo, Hans Ågren, Olav Vahtras, Paul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 453 KB

english, 1993

80

Do shape resonances exist in core electron shake spectra of free molecules?

Svante Svensson, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 322 KB

english, 1993

81

Multiconfigurational quadratic response theory calculations of two-photon electronic transition probabilities of H2O

Yi Luo, Olav Vahtras, Hans Ågren, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 649 KB

english, 1993

82

The interpretation of the Wulf absorption band of ozone

Boris Minaev, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 717 KB

english, 1994

83

Direct, atomic orbital, static exchange calculations of photoabsorption spectra of large molecules and clusters

Hans Ågren, Vincenzo Carravetta, Olav Vahtras, Lars G.M. Pettersson

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 588 KB

english, 1994

84

The Vegard-Kaplan band and the phosphorescent decay of N2

Jeppe Olsen, Boris Minaev, Olav Vahtras, Hans Ågren, Poul Jørgensen, Hans Jørgen Aa. Jensen, Trygve Helgaker

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 728 KB

english, 1994

85

Size dependency of soft X-ray emission spectra. Calculations on finite polyenes and polyacetylene

Yi Luo, Christoph Liegener, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 377 KB

english, 1995

86

Resonant and non-resonant X-ray scattering from C70

Jinghua Guo, Per Skytt, Nial Wassdahl, Joseph Nordgren, Yi Luo, Olav Vahtras, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 558 KB

english, 1995

87

Cubic response functions in the random phase approximation

Patrick Norman, Dan Jonsson, Olav Vahtras, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 510 KB

english, 1995

88

The hyperpolarizability of the tricyanomethanide molecular ion in solution

Yi Luo, Amary Cesar, Hans Ågren

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 627 KB

english, 1996

89

On the interpretation of the NEXAFS spectrum of molecular oxygen

Hans Ågren, Li Yang, Vincenzo Carravetta, Lars G.M. Pettersson

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 447 KB

english, 1996

90

X-ray spectra and core hole energy curves of some diatomic molecules

Hans Ågren, Lennart Selander, Joseph Nordgren, Carl Nordling, Kai Siegbahn, Jiri Müller

Journal:

Chemical Physics

Year:

1979

Language:

english

File:

PDF, 937 KB

english, 1979

91

On the possibility of bremsstrahlung—isochromat spectroscopy for gas-phase molecules

Hans Ågren, Nils Mårtensson, Rolf Manne

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 825 KB

english, 1985

92

A self-consistent reaction field approach to liquid photoionization

Hans Ågren, Carmen Median Llanos, Kurt V. Mikkelsen

Journal:

Chemical Physics

Year:

1987

Language:

english

File:

PDF, 1.16 MB

english, 1987

93

Accurate photoionization cross sections of diatomic molecules by multi-configuration linear response theory

Vincenzo Carravetta, Yi Luo, Hans Ågren

Journal:

Chemical Physics

Year:

1993

Language:

english

File:

PDF, 1.46 MB

english, 1993

94

Radiative lifetimes of triplet spin sublevels of the azabenzenes

Hans Ågren, Olav Vahtras, Sören Knuts, Poul Jørgensen

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.30 MB

english, 1994

95

Response theory calculations of singlet-triplet transitions in molecular nitrogen

Boris Minaev, Patrick Norman, Dan Jonsson, Hans Ågren

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 1.52 MB

english, 1995

96

On the interpretation of the external heavy atom effect on singlet-triplet transitions

Boris F. Minaev, Sören Knuts, Hans Ågren

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 1.37 MB

english, 1994

97

Auger spectra of linear alkynes and alkenes. Experiment and theory

Christoph Liegener, Svante Svensson, Hans Ågren

Journal:

Chemical Physics

Year:

1994

Language:

english

File:

PDF, 884 KB

english, 1994

98

Character and spectra of triplet states in short polyenes

Boris F. Minaev, Dan Jonsson, Patrik Norman, Hans Ågren

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 901 KB

english, 1995

99

Near-edge core photoabsorption in polyacenes: model molecules for graphite

Hans Ågren, Olav Vahtras, Vincenzo Carravetta

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 855 KB

english, 1995

100

Non-linear electric and magnetic properties obtained from cubic response functions in the random phase approximation

Patrick Norman, Dan Jonsson, Olav Vahtras, Hans Ågren

Journal:

Chemical Physics

Year:

1996

Language:

english

File:

PDF, 1.02 MB

english, 1996