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Paper written by Moriyama
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Gaussian-type functions for the 3d Rydberg and 3d correlation orbitals in B to Ne and Al to Ar.
Hiroko Moriyama and Hiroshi Tatewaki
Mol. Phys. 101, 53-63 (2003)
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The singlet excited states of the F2 molecule.
H. Moriyama, Y, Wasada-Tsutsui, M. Sekiya, and H. Tatewaki
J. Chem. Phys. 118, 5413-5421 (2003)
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Rydberg vibrational states smeared out in the valence (ionic)
vibrational states:
C and G 1Σu+for F2
H. Tatewaki, N. Honjou, H. Moriyama
Chem. Phys. Lett. 404, 318-322 (2005)
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Purturbers of the silicon
(3s)2(3p)1(md)1 1Do Rydbergseries
- importance of the spin-orbit interaction
H. Moriyama, S. Yamamoto, H. Tatewaki
Chem. Phys. Lett. 415, 283-286 (2005)
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A study of the ground state of manganese dimer
using quasidegenerate perturbation theory
S. Yamamoto, H. Tatewaki, H. Moriyama, H. Nakano
J. Chem. Phys. 124, 124302 (2006)
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Electronic Structure of LaF+ and LaF from Frozen-Core Four-Component Relativistic Multiconfigurational Quasidegenerate perturbation Theory
H. Moriyama, Y. Watanabe, H. Nakano, and H. Tatewaki
J. Phys. Chem. A 112, 2683-2692 (2008)
- Molecular Spinors Suitable for Four-Component Relativistic Correlation Calculations:
Studies of LaF+ and LaF Using Multiconfigurational Quasi-Degenerate Perturbation Theory
H. Moriyama, Y. Watanabe, H. Nakano, and H. Tatewaki
Int. J. Quantum Chem. accepted
- Electron affinity of lead:
An ab initio four-component relativistic study
H. Tatewaki, S. Yamamoto, H. Moriyama, Y. Watanabe
Chem. Phys. Lett. 470, 158-161 (2009)
- Electronic structure of LaO based on frozen-core four-component relativistic multiconfigurational quasidegenerate perturbation theory
Hiroko Moriyama, Yoshihiro Watanabe, Haruyuki Nakano, Shigeyoshi Yamamoto, and Hiroshi Tatewaki
J. Chem. Phys. 132, 124310-1-9 (2010)
cgtf sets for 3d Rydberg orbitals
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