lanthanide monoxides
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Segmented all-electron basis sets of triple zeta quality for the lanthanides: application to structure calculations of lanthanide monoxides

Journal of Molecular Modeling ◽

10.1007/s00894-019-3924-8 ◽

2019 ◽

Vol 25 (2) ◽

Cited By ~ 2

Author(s):

A. Z. de Oliveira ◽

I. B. Ferreira ◽

C. T. Campos ◽

F. E. Jorge ◽

P. A. Fantin

Keyword(s):

Basis Sets ◽

Triple Zeta ◽

Lanthanide Monoxides ◽

Structure Calculations

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Elastic and mechanical properties of lanthanide monoxides

Journal of Alloys and Compounds ◽

10.1016/j.jallcom.2014.08.171 ◽

2015 ◽

Vol 618 ◽

pp. 292-298 ◽

Cited By ~ 18

Author(s):

M. Shafiq ◽

Suneela Arif ◽

Iftikhar Ahmad ◽

S. Jalali Asadabadi ◽

M. Maqbool ◽

...

Keyword(s):

Mechanical Properties ◽

Lanthanide Monoxides

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Probing the electronic structure, magnetotropicity, and absorption spectra of benzene trapped by lanthanide monoxides, C6 H6 ···LnO, using DFT methods

International Journal of Quantum Chemistry ◽

10.1002/qua.24051 ◽

2012 ◽

Vol 113 (5) ◽

pp. 694-708

Author(s):

Athanassios Tsipis ◽

Dimitrios Gkarmpounis

Keyword(s):

Electronic Structure ◽

Absorption Spectra ◽

Dft Methods ◽

Lanthanide Monoxides

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Ligand field calculation of the lower electronic energy levels of the lanthanide monoxides

Journal of Molecular Spectroscopy ◽

10.1016/0022-2852(88)90241-x ◽

1988 ◽

Vol 131 (2) ◽

pp. 301-324 ◽

Cited By ~ 46

Author(s):

P. Carette ◽

A. Hocquet

Keyword(s):

Energy Levels ◽

Electronic Energy ◽

Ligand Field ◽

Field Calculation ◽

Electronic Energy Levels ◽

Lanthanide Monoxides

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