Electronic structure and chemical bonding in the ground states of Tc 2 and Re2

Molecular Physics

Volumn 107, Issue 8-12, 2009, Pages 1035-1040

  Borin, Antonio Carlos ^a   Paulo Gobbo, João ^a   Roos, Bjorn O ^b  

^a UNIVERSITY OF SÃO PAULO   (Brazil)

^b LUND UNIVERSITY   (Sweden)

Author keywords

CASPT2; Ground state; Transition metal bonding; Transition metal diatoms

Indexed keywords

BOND ORDERS; CASPT2; CHEMICAL BONDINGS; DISSOCIATION ENERGIES; EXPERIMENTAL EVIDENCE; MULTICONFIGURATION; RELATIVISTIC EFFECTS; SECOND ORDER PERTURBATION THEORY; SPIN-ORBIT COUPLINGS;

CHEMICAL BONDS; DISSOCIATION; ELECTRONIC STRUCTURE; METALS; PERTURBATION TECHNIQUES; PHYTOPLANKTON; TECHNETIUM; TELLURIUM COMPOUNDS;

GROUND STATE;

EID: 68249162219     PISSN: 00268976     EISSN: 13623028     Source Type: Journal    
DOI: 10.1080/00268970802712555     Document Type: Article

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