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51

The magnetic hyperpolarizability anisotropy of the neon atom

Michał Jaszuński, Hans Jørgen Aa. Jensen, Poul Jørgensen, Antonio Rizzo, Trygve Helgaker, Kenneth Ruud

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 268 KB

english, 1992

52

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

53

Comparison of coupled-cluster and Brueckner coupled-cluster calculations of molecular properties

Rika Kobayashi, Henrik Koch, Poul Jørgensen, Timothy J. Lee

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 575 KB

english, 1993

54

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

55

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

56

The hyperpolarizability of neon revisited

Ove Christiansen, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 411 KB

english, 1993

57

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

58

Nuclear magnetic shielding tensor for the ethylenic carbon atom in tetrachlorocyclopropene

Michal Jaszunski, Keld L. Bak, Poul Jørgensen, Trygve Helgaker, Kenneth Ruud, Hans Jørgen, Aa. Jensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 197 KB

english, 1993

59

Quartic coupled cluster force fields for the diazene isomers

Rika Kobayashi, Ota Bludský, Henrik Koch, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1993

Language:

english

File:

PDF, 475 KB

english, 1993

60

MCSCF calculations of nitrogen NMR shielding constants using London atomic orbitals

Michal Jaszunski, Trygve Helgaker, Kenneth Ruud, Keld L. Bak, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 645 KB

english, 1994

61

MCSCF calculations of Verdet constants

Michal Jaszunski, Poul Jørgensen, Antonio Rizzo, Kenneth Ruud, Trygve Helgaker

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 359 KB

english, 1994

62

Theoretical calculations of the magnetizability of some small fluorine-containing molecules using London atomic orbitals

Kenneth Ruud, Trygve Helgaker, Poul Jørgensen, Keld L. Bak

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 584 KB

english, 1994

63

An ab initio nuclear magnetic resonance spectrum of vinyllithium

Kenneth Ruud, Trygve Helgaker, Poul Jørgensen, Keld L. Bak

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 767 KB

english, 1994

64

A direct atomic orbital driven implementation of the coupled cluster singles and doubles (CCSD) model

Henrik Koch, Ove Christiansen, Rika Kobayashi, Poul Jørgensen, Trygve Helgaker

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 439 KB

english, 1994

65

An ab initio quartic force field and the fundamental frequencies ofo-benzyne

Ota Bludsky´, Vladimi´r Sˇpirko, Rika Kobayashi, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1994

Language:

english

File:

PDF, 416 KB

english, 1994

66

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

67

Evaluation of hyperfine coupling tensors of the BeH and BeF radicals

Berta Fernandez, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 644 KB

english, 1995

68

NMR properties of N3−. A comparison of theory and experiment

Michał Jaszuński, Sławomir Szymański, Ove Christiansen, Poul Jørgensen, Trygve Helgaker, Kenneth Ruud

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 539 KB

english, 1995

69

The second-order approximate coupled cluster singles and doubles model CC2

Ove Christiansen, Henrik Koch, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 747 KB

english, 1995

70

Excitation energies of BH, CH2 and Ne in full configuration interaction and the hierarchy CCS, CC2, CCSD and CC3 of coupled cluster models

Henrik Koch, Ove Christiansen, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics Letters

Year:

1995

Language:

english

File:

PDF, 541 KB

english, 1995

71

Dynamic CCSD polarisabilities of CHF3 and CHCl3

Rika Kobayashi, Roger D. Amos, Henrik Koch, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 238 KB

english, 1996

72

Excitation energies of H2O, N2 and C2 in full configuration interaction and coupled cluster theory

Ove Christiansen, Henrik Koch, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 717 KB

english, 1996

73

On the inherent divergence in the Møller-Plesset series. The neon atom — a test case

Ove Christiansen, Jeppe Olsen, Poul Jørgensen, Henrik Koch, Per-Åke Malmqvist

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 583 KB

english, 1996

74

Ab initio potential energy function and geometry of the Ã state of ammonia

Vladimír Špirko, Poul Jørgensen, Hans Jørgen Aa. Jensen

Journal:

Journal of Molecular Spectroscopy

Year:

1992

Language:

english

File:

PDF, 409 KB

english, 1992

75

Polarization propagator methods in atomic and molecular calculations

Jens Oddershede, Poul Jørgensen, Danny L. Yeager

Journal:

Computer Physics Reports

Year:

1984

Language:

english

File:

PDF, 4.16 MB

english, 1984

76

Coupled hartree-fock and second order polarization propagator calculations of indirect nuclear spin-spin coupling constants for diatomic molecules

Jens Oddershede, Poul Jørgensen, Nelson H.F. Beebe

Journal:

Chemical Physics

Year:

1977

Language:

english

File:

PDF, 640 KB

english, 1977

77

Proper characterization of MC SCF stationary points

Joseph T. Golab, Danny L. Yeager, Poul Jørgensen

Journal:

Chemical Physics

Year:

1983

Language:

english

File:

PDF, 2.07 MB

english, 1983

78

Higher molecular-deformation derivatives of the configuration-interaction energy

Jack Simons, Poul Jørgensen, Trygve U. Helgaker

Journal:

Chemical Physics

Year:

1984

Language:

english

File:

PDF, 1.68 MB

english, 1984

79

Multiple stationary point representations in MC SCF calculations

Joseph T. Golab, Danny L. Yeager, Poul Jørgensen

Journal:

Chemical Physics

Year:

1985

Language:

english

File:

PDF, 1.96 MB

english, 1985

80

Direct iterative RPA calculations. Applications to ethylene, benzene and cytosine

Hans Jørgen, Aa. Jensen, Henrik Koch, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics

Year:

1988

Language:

english

File:

PDF, 877 KB

english, 1988

81

Dipole polarizability surfaces of ammonia

Vladimir Špirko, Hans Jørgen Aa. Jensen, Poul Jørgensen

Journal:

Chemical Physics

Year:

1990

Language:

english

File:

PDF, 629 KB

english, 1990

82

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

83

Accurate magnetizabilities of the isoelectronic series BeH−, BH, and CH+. The MCSCF-GIAO approach

Kenneth Ruud, Trygve Helgaker, Keld L. Bak, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics

Year:

1995

Language:

english

File:

PDF, 801 KB

english, 1995

84

Comments to “Analysis of constant rate period of spray drying of slurry” by Liang et al., 2001

Kåre Jørgensen, Anker D. Jensen, Jakob Sloth, Kim Dam-Johansen, Poul Bach

Journal:

Chemical Engineering Science

Year:

2006

Language:

english

File:

PDF, 176 KB

english, 2006

85

Activity-based costing as a method for assessing the economics of modularization—A case study and beyond

Jesper Thyssen, Poul Israelsen, Brian Jørgensen

Journal:

International Journal of Production Economics

Year:

2006

Language:

english

File:

PDF, 323 KB

english, 2006

86

Decentralizing decision making in modularization strategies: Overcoming barriers from dysfunctional accounting systems

Poul Israelsen, Brian Jørgensen

Journal:

International Journal of Production Economics

Year:

2011

Language:

english

File:

PDF, 195 KB

english, 2011

87

Acoustic monitoring of a fluidized bed coating process

Kaisa Naelapää, Peep Veski, Joan G. Pedersen, Dan Anov, Pia Jørgensen, Henning G. Kristensen, Poul Bertelsen

Journal:

International Journal of Pharmaceutics

Year:

2007

Language:

english

File:

PDF, 1.03 MB

english, 2007

88

Nondestructive detection of internal bruise and spraing disease symptoms in potatoes using magnetic resonance imaging

Anette K. Thybo, Sune N. Jespersen, Poul Erik Lærke, Hans J. Stødkilde-Jørgensen

Journal:

Magnetic Resonance Imaging

Year:

2004

Language:

english

File:

PDF, 269 KB

english, 2004

89

Diagnostic accuracy of myocardial perfusion imaging in a study population without post-test referral bias

Allan Johansen, Poul Flemming Høilund-Carlsen, Henrik Wulff Christensen, Werner Vach, Henrik Boel Jørgensen, Annegrete Veje, Torben Haghfelt

Journal:

Journal of Nuclear Cardiology

Year:

2005

Language:

english

File:

PDF, 152 KB

english, 2005

90

Gauge invariance of oscillator strengths in the approximate coupled cluster triples model CC3

Filip Pawłowski, Poul Jørgensen, Christof Hättig

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 237 KB

english, 2004

91

The hyperpolarizability of the Ne atom in the approximate coupled cluster triples model CC3

Filip Pawłowski, Poul Jørgensen, Christof Hättig

Journal:

Chemical Physics Letters

Year:

2004

Language:

english

File:

PDF, 256 KB

english, 2004

92

Coupled cluster calculations of the optical rotation of S-propylene oxide in gas phase and solution

Jacob Kongsted, Thomas Bondo Pedersen, Mikkel Strange, Anders Osted, Aage E. Hansen, Kurt V. Mikkelsen, Filip Pawlowski, Poul Jørgensen, Christof Hättig

Journal:

Chemical Physics Letters

Year:

2005

Language:

english

File:

PDF, 182 KB

english, 2005

93

The second hyperpolarizability of the N2 molecule calculated using the approximate coupled cluster triples model CC3

Filip Pawłowski, Poul Jørgensen, Christof Hättig

Journal:

Chemical Physics Letters

Year:

2005

Language:

english

File:

PDF, 232 KB

english, 2005

94

Impact and attrition shear breakage of enzyme granules and placebo particles-application to particle design and formulation

Kåre Jørgensen, Poul Bach, Anker D. Jensen

Journal:

Powder Technology

Year:

2005

Language:

english

File:

PDF, 852 KB

english, 2005

95

Direct optimization of the AO density matrix in Hartree–Fock and Kohn–Sham theories

Trygve Helgaker, Helena Larsen, Jeppe Olsen, Poul Jørgensen

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 87 KB

english, 2000

96

Triple excitation effects in coupled cluster calculations of Verdet constants

Sonia Coriani, Poul Jørgensen, Ove Christiansen, Jürgen Gauss

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 172 KB

english, 2000

97

Comparison of full-configuration interaction and coupled-cluster harmonic and fundamental frequencies for BH and HF

Helena Larsen, Jeppe Olsen, Poul Jørgensen, Jürgen Gauss

Journal:

Chemical Physics Letters

Year:

2001

Language:

english

File:

PDF, 82 KB

english, 2001

98

Calculation of ground and excited state potential energy curves of the MgAr complex using the coupled cluster approximate triples model CC3

Kasper Hald, Poul Jørgensen, W.H Breckenridge, Michał Jaszuński

Journal:

Chemical Physics Letters

Year:

2002

Language:

english

File:

PDF, 98 KB

english, 2002

99

Coupled-cluster connected-quadruples corrections to atomization energies

Torgeir A Ruden, Trygve Helgaker, Poul Jørgensen, Jeppe Olsen

Journal:

Chemical Physics Letters

Year:

2003

Language:

english

File:

PDF, 89 KB

english, 2003

100

Integral direct calculation of CC2 excitation energies: singlet excited states of benzene

Ove Christiansen, Henrik Koch, Poul Jørgensen, Trygve Helgaker

Journal:

Chemical Physics Letters

Year:

1996

Language:

english

File:

PDF, 716 KB

english, 1996

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