Six questions on topology in theoretical chemistry

P.L. Ayers, R.J. Boyd, P. Bultinck, M. Caffarel, R. Carbö-D̈orca, M. Causà, J. Ciosłowski, J. Contreras-García, D.L. Cooper, P. Coppens, C. Gatti, Simon Grabowsky, P. Lazzeretti, P. Macchi, A.M. Martín Pendás, P.L.A. Popelier, K. Ruedenberg, H.S. Rzepa, A. Savin, A.F. SaxW.H.E. Schwarz, S. Shahbazian, B. Silvi, M. Solà, V.G. Tsirelson

Research output: Contribution to journalArticle

69 Citations (Scopus)

Abstract

© 2014 Elsevier B.V. The paper collects the answers of the authors to the following questions:. •What is the significance of topological approach?•Can new chemical concepts be found by a topological approach?•What is the status of a chemical concept within a topological approach?•Should topological approaches provide measurable quantities?•Is it possible to predict the outcome of a topological approach without performing a calculation on a computer?•What are new domains for which topological approaches would be useful?
Original languageEnglish
Pages (from-to)2-16
JournalComputational and Theoretical Chemistry
Volume1053
DOIs
Publication statusPublished - 2015

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