International Journal of Quantum Chemistry: Vol 25, No 1

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International Journal of Quantum Chemistry

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International Journal of Quantum Chemistry: Volume 25, Issue 1

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Introduction

Introduction

Articles

Foundations of the relativistic theory of many-electron bound states ^†^‡

Relativistic atomic structure theory: Some recent work ^†

Relativistic studies of atoms and ions with complex configurations ^†

Isospin basis for atoms in relativistic approximation ^†

Relativistic calculation of autoionization widths of 1s2s2p_jJ, 1s2s² ²S_1/2, and 1s2p_J ²p_j′J levels

1/Z perturbation theory for calculation of line strengths in the neon isoelectronic sequence

Core polarization and relativistic effects competition in the first ionization potentials for some systems in the Cu, Ag, and Au isoelectronic sequences ^†

Use of the S-matrix in the relativistic treatment of resonance energy transfer

Collision systems

Basis set expansion of the dirac operator without variational collapse

Relativistic calculations of dissociation energies and related properties

Electronic structure of molecules using one-component wave functions and relativistic effective core potentials

Self-consistent Dirac–Slater calculations for molecules and embedded clusters

Electronic structure of the PdCl₄²⁻ and PtCl₄²⁻ions

Electronegativity equalization and the electronic structure of polyhedral clusters of main-group atoms

Spin-orbit excitation in the system I + I₂: Relativistically parameterized extended-Hückel calculations ^†

Relativistic band structure calculations

Relativistic corrections to the valence and conduction band edges of anisotropic semiconductors

Announcement

Announcement. International academy of quantum molecular sciences

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International Journal of Quantum Chemistry

Journal list menu

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International Journal of Quantum Chemistry: Volume 25, Issue 1

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Masthead

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Introduction

Introduction

Articles

Foundations of the relativistic theory of many-electron bound states†‡

Relativistic atomic structure theory: Some recent work†

Relativistic studies of atoms and ions with complex configurations†

Isospin basis for atoms in relativistic approximation†

Relativistic calculation of autoionization widths of 1s2s2pjJ, 1s2s2 2S1/2, and 1s2pJ 2pj′J levels

1/Z perturbation theory for calculation of line strengths in the neon isoelectronic sequence

Core polarization and relativistic effects competition in the first ionization potentials for some systems in the Cu, Ag, and Au isoelectronic sequences†

Use of the S-matrix in the relativistic treatment of resonance energy transfer

Collision systems

Basis set expansion of the dirac operator without variational collapse

Relativistic calculations of dissociation energies and related properties

Electronic structure of molecules using one-component wave functions and relativistic effective core potentials

Self-consistent Dirac–Slater calculations for molecules and embedded clusters

Electronic structure of the PdCl42− and PtCl42−ions

Electronegativity equalization and the electronic structure of polyhedral clusters of main-group atoms

Spin-orbit excitation in the system I + I2: Relativistically parameterized extended-Hückel calculations†

Relativistic band structure calculations

Relativistic corrections to the valence and conduction band edges of anisotropic semiconductors

Announcement

Announcement. International academy of quantum molecular sciences

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More from this journal

Foundations of the relativistic theory of many-electron bound states ^†^‡

Relativistic atomic structure theory: Some recent work ^†

Relativistic studies of atoms and ions with complex configurations ^†

Isospin basis for atoms in relativistic approximation ^†

Relativistic calculation of autoionization widths of 1s2s2p_jJ, 1s2s² ²S_1/2, and 1s2p_J ²p_j′J levels

Core polarization and relativistic effects competition in the first ionization potentials for some systems in the Cu, Ag, and Au isoelectronic sequences ^†

Electronic structure of the PdCl₄²⁻ and PtCl₄²⁻ions

Spin-orbit excitation in the system I + I₂: Relativistically parameterized extended-Hückel calculations ^†