Aufbau algorithms and the structure of small molecular clusters

B.W. van de Waal

doi:10.1107/S010876738400060X

Aufbau algorithms and the structure of small molecular clusters

B.W. van de Waal

Faculty of Science and Technology

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Abstract

In a comment [van de Waal (1981). Acta Cryst. A37, 762-764] on a paper by D. E. Williams [Acta Cryst. (1980), A36, 715-723] on the conformation of small clusters of benzene molecules, it was understood that Williams's results had been obtained from the application of an aufbau algorithm. Subsequently, it was made clear by Williams (private communication) that his results were actually derived from the reversed procedure. In the present note a comparison is made between the two approaches

Original language	Undefined
Pages (from-to)	306-307
Journal	Acta crystallographica Section A: Foundations of crystallography
Volume	40
DOIs	https://doi.org/10.1107/S010876738400060X
Publication status	Published - 1984

Keywords

IR-59199

Access to Document

10.1107/S010876738400060X

Waal84aufbau

Cite this

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KW - IR-59199

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DO - 10.1107/S010876738400060X

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JO - Acta crystallographica Section A: Foundations of crystallography

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