Recent progress in theoretical investigations of the electronic structure of the transactinides

V. Pershina; T. Bastug; B. Fricke

doi:10.1016/S0925-8388(98)00071-1

Recent progress in theoretical investigations of the electronic structure of the transactinides

V. Pershina
, T. Bastug
, B. Fricke

Research output: Contribution to journal › Article › peer-review

6 Citations (Scopus)

Abstract

An overview is given of the recent development in the theory of molecular codes focusing on a newly developed version of the Dirac-Slater discrete-variational (DS-DV) method for complex multiatomic systems. Emphasis is put on the calculations of the chemical bonding in heavy element compounds. A new model to predict complex formation and extraction of the transactinides on the basis of the DS-DV molecular-orbital calculations is presented.

Original language	English
Pages (from-to)	283-286
Number of pages	4
Journal	Journal of Alloys and Compounds
Volume	271-273
DOIs	https://doi.org/10.1016/S0925-8388(98)00071-1
Publication status	Published - 12 Jun 1998
Externally published	Yes

Keywords

Complex formation
Relativistic molecular calculations
Transactinides

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10.1016/S0925-8388(98)00071-1

Cite this

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abstract = "An overview is given of the recent development in the theory of molecular codes focusing on a newly developed version of the Dirac-Slater discrete-variational (DS-DV) method for complex multiatomic systems. Emphasis is put on the calculations of the chemical bonding in heavy element compounds. A new model to predict complex formation and extraction of the transactinides on the basis of the DS-DV molecular-orbital calculations is presented.",

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author = "V. Pershina and T. Bastug and B. Fricke",

year = "1998",

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doi = "10.1016/S0925-8388(98)00071-1",

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T1 - Recent progress in theoretical investigations of the electronic structure of the transactinides

AU - Pershina, V.

AU - Bastug, T.

AU - Fricke, B.

PY - 1998/6/12

Y1 - 1998/6/12

N2 - An overview is given of the recent development in the theory of molecular codes focusing on a newly developed version of the Dirac-Slater discrete-variational (DS-DV) method for complex multiatomic systems. Emphasis is put on the calculations of the chemical bonding in heavy element compounds. A new model to predict complex formation and extraction of the transactinides on the basis of the DS-DV molecular-orbital calculations is presented.

AB - An overview is given of the recent development in the theory of molecular codes focusing on a newly developed version of the Dirac-Slater discrete-variational (DS-DV) method for complex multiatomic systems. Emphasis is put on the calculations of the chemical bonding in heavy element compounds. A new model to predict complex formation and extraction of the transactinides on the basis of the DS-DV molecular-orbital calculations is presented.

KW - Complex formation

KW - Relativistic molecular calculations

KW - Transactinides

UR - https://www.scopus.com/pages/publications/0032094129

U2 - 10.1016/S0925-8388(98)00071-1

DO - 10.1016/S0925-8388(98)00071-1

M3 - Article

AN - SCOPUS:0032094129

SN - 0925-8388

VL - 271-273

SP - 283

EP - 286

JO - Journal of Alloys and Compounds

JF - Journal of Alloys and Compounds

ER -

Recent progress in theoretical investigations of the electronic structure of the transactinides

Abstract

Keywords

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