Case studies of some atoms-in-molecules formulations

1983 ◽  
Vol 48 (7) ◽  
pp. 1799-1809 ◽  
Author(s):  
Rudolf Polák ◽  
Jan Vojtík

Four versions (Hermitian, non-Hermitian, Schmidt- and symmetrically orthogonalized) of the atoms-in-molecules method are applied to calculate potential energy curves of the H2, HeH and HF species. By comparing the results of various approaches among themselves and to external accurate data, conclusions are drawn concerning the reliability of the individual solutions.

Author(s):  
Susanna Braund ◽  
Zara Martirosova Torlone

The introduction describes the broad landscape of translation of Virgil from both the theoretical and the practical perspectives. It then explains the genesis of the volume and indicates how the individual chapters, each one of which is summarized, fit into the complex tapestry of Virgilian translation activity through the centuries and across the world. The volume editors indicate points of connection between the chapters in order to render the whole greater than the sum of its parts. Braund and Torlone emphasize that a project such as this could look like a (rather large) collection of case studies; they therefore consider it important to extrapolate larger phenomena from the specifics presented here


1979 ◽  
Vol 66 (3) ◽  
pp. 523-526 ◽  
Author(s):  
Okio Nomura ◽  
Suehiro Iwata

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