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Journal of Molecular Structure: THEOCHEM

Volumn 573, Issue 1-3, 2001, Pages 181-200

Two-component methods of relativistic quantum chemistry: From the Douglas-Kroll approximation to the exact two-component formalism

(2) Barysz, Maria a Sadlej, Andrzej J a

a NICOLAUS COPERNICUS UNIVERSITY (Poland)

Author keywords

Change of picture; Douglas Kroll approximation; Douglas Kroll Hess method; Exact two component hamiltonian; Expectation values; Relativistic effects on atomic and molecular properties; Relativistic methods; Two component methods

Indexed keywords

MATHEMATICAL ANALYSIS; MOLECULAR DYNAMICS; NONLINEAR SYSTEM; PHASE TRANSITION; QUANTUM CHEMISTRY; REVIEW; STRUCTURE ANALYSIS;

EID: 0035955520 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(01)00542-5 Document Type: Article

Times cited : (202)

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