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QC-DMRG study of the ionic-neutral curve crossing of LiF

Molecular physics, 2003-07, Vol.101 (13), p.2019-2028

2003

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Spin–orbit corrections to NMR shielding constants from density functional theory. How important are the two-electron terms?

Chemical physics letters, 1998-10, Vol.296 (1), p.93-104

1998

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Judd–Ofelt theory in a new light on its (almost) 40th anniversary

Journal of alloys and compounds, 2001-07, Vol.323, p.645-648

2001

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Theory of host sensitized luminescence of rare earth doped materials

Journal of alloys and compounds, 2002-04, Vol.336 (1-2), p.56-61

2002

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Theory of host sensitized luminescence of rare earth doped materials: III. Numerical illustration

Journal of alloys and compounds, 2002-04, Vol.336 (1-2), p.56-61

2002

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The aromaticity of heterocycles containing the imine nitrogen

Tetrahedron, 1975, Vol.31 (4), p.295-298

1975

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Theoretical study of reactivity of methane, methyl fluoride, and methyl chloride: interaction with their radical cations and proton donors

Journal of the American Chemical Society, 1990-07, Vol.112 (15), p.5731-5735

1990

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Application of the GAPT (generalized atomic polar tensor) population analysis to some organic molecules and transition structures

Journal of the American Chemical Society, 1990-05, Vol.112 (11), p.4183-4186

1990

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Rearrangement of fluorinated methylenecyclopropane

Journal of fluorine chemistry, 1989-10, Vol.45 (1), p.129-129

1989

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Diastereotopically distinct secondary deuterium kinetic isotope effects on the thermal isomerization of cis-hexatriene to 1,3-cyclohexadiene

Journal of the American Chemical Society, 1988-12, Vol.110 (25), p.8554-8555

1988

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Spin polarized photoelectrons from CO 2 and N 2O

Chemical physics letters, 1980, Vol.69 (2), p.284-289

1980

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Spin polarized photoelectrons from CO2 and N2O

Chemical physics letters, 1980-01, Vol.69 (2), p.284-289

1980

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Diels-alder reactivity of polycyclic aromatic hydrocarbons-5

Tetrahedron, 1981-01, Vol.37 (17), p.2983-2987

1981

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Ab initio second-order Moller-Plesset calculation of the vibrational spectra of cyclobutadiene and its isotopic derivatives

Journal of the American Chemical Society, 1983-02, Vol.105 (4), p.695-701

1983

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Total and orbital SCF energies in molecules

The Journal of chemical physics, 1984-06, Vol.80 (11), p.5861-5862

1984

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Diels-alder reactivity of polycyclic aromatic hydrocarbons-5: Theoretical correlations

Tetrahedron, 1981, Vol.37 (17), p.2983-2987

1981

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The dipole moment derivatives and charge flux parameters from vibrational absorption intensities of ethylene oxide

Journal of molecular spectroscopy, 1985, Vol.109 (1), p.22-29

1985

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Proof of a conjecture by Dacre on the symmetry of two-electron integrals

Chemical physics letters, 1984-03, Vol.105 (4), p.433-434

1984

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A correlation between PMR coupling constants and REPE in nitrogen heterocycles

Tetrahedron letters, 1977, Vol.18 (6), p.535-538

1977

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The stabilization of thiepin by substitution

Tetrahedron, 1977, Vol.33 (20), p.2683-2685

1977

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The aromatic stabilization of porphyrins

Journal of theoretical biology, 1976-06, Vol.59 (1), p.237-240

1976

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Correspondence between theoretically predicted and experimentally observed sites of electrophilic substitution on a fused-tricyclic heteroaromatic (azulene) system

Tetrahedron letters, 1975, Vol.16 (25), p.2077-2080

1975

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Quark chemistry

Physical review. A, General physics, 1981-04, Vol.23 (4), p.1600-1607

1981

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Intracranial Vessel Wall MRI: Principles and Expert Consensus Recommendations of the American Society of Neuroradiology

American journal of neuroradiology : AJNR, 2017-02, Vol.38 (2), p.218-229

2017

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A Multidimensional Home-Based Care Coordination Intervention for Elders with Memory Disorders: The Maximizing Independence at Home (MIND) Pilot Randomized Trial

The American journal of geriatric psychiatry, 2014-04, Vol.22 (4), p.398-414

2014

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QC-DMRG study of the ionic-neutral curve crossing of LiF

Spin–orbit corrections to NMR shielding constants from density functional theory. How important are the two-electron terms?

Judd–Ofelt theory in a new light on its (almost) 40th anniversary

Theory of host sensitized luminescence of rare earth doped materials

Theory of host sensitized luminescence of rare earth doped materials: III. Numerical illustration

The aromaticity of heterocycles containing the imine nitrogen

Theoretical study of reactivity of methane, methyl fluoride, and methyl chloride: interaction with their radical cations and proton donors

Application of the GAPT (generalized atomic polar tensor) population analysis to some organic molecules and transition structures

Rearrangement of fluorinated methylenecyclopropane

Diastereotopically distinct secondary deuterium kinetic isotope effects on the thermal isomerization of cis-hexatriene to 1,3-cyclohexadiene

Spin polarized photoelectrons from CO 2 and N 2O

Spin polarized photoelectrons from CO2 and N2O

Diels-alder reactivity of polycyclic aromatic hydrocarbons-5

Ab initio second-order Moller-Plesset calculation of the vibrational spectra of cyclobutadiene and its isotopic derivatives

Total and orbital SCF energies in molecules

Diels-alder reactivity of polycyclic aromatic hydrocarbons-5: Theoretical correlations

The dipole moment derivatives and charge flux parameters from vibrational absorption intensities of ethylene oxide

Proof of a conjecture by Dacre on the symmetry of two-electron integrals

A correlation between PMR coupling constants and REPE in nitrogen heterocycles

The stabilization of thiepin by substitution

The aromatic stabilization of porphyrins

Correspondence between theoretically predicted and experimentally observed sites of electrophilic substitution on a fused-tricyclic heteroaromatic (azulene) system

Quark chemistry

Intracranial Vessel Wall MRI: Principles and Expert Consensus Recommendations of the American Society of Neuroradiology

A Multidimensional Home-Based Care Coordination Intervention for Elders with Memory Disorders: The Maximizing Independence at Home (MIND) Pilot Randomized Trial

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