Molecular Clusters to Nanomaterials

Singh, N.; Lee, H.; Suh, S.; Kołaski, M.; Kim, K.

Artykuł - szczegóły

Tytuł artykułu

Molecular Clusters to Nanomaterials

Autorzy

Singh N. , Lee H. , Suh S. , Kołaski M. , Kim K.

Identyfikatory

Warianty tytułu

Języki publikacji

Abstrakty

Theoretical investigations of gas phase clusters enable the evaluation of intrinsic molecular properties and intermolecular interactions. Based on the microscopic determination of the properties of individual atoms, molecules, or clusters, one can predict the macroscopic properties of bulk matter. With the aid of theoretical insights into the interaction forces holding these clusters and subsequent properties of a large number of cluster systems (ranging from simple water clusters to large pi-systems), we have investigated the properties of various novel molecular systems including endo/exohedral fullerenes, nanotori, nonlinear optical materials, ionophores/receptors, polypeptides, enzymes, organic nanotubes, nanowires, and electronic and nano-mechanical molecular devices. This mini-review highlights some of the interesting results obtained in the course of our extensive theoretical investigations of clusters toward the molecular design approach of nanomaterials.

Słowa kluczowe

computer-aided molecular design molecular clusters ionophores nanotubes nanomaterials

Wydawca

Polskie Towarzystwo Chemiczne

Czasopismo

Polish Journal of Chemistry

Rocznik

2007

Tom

Vol. 81, nr 5-6

Strony

1021--1035

Opis fizyczny

Bibliogr. 216 poz., rys.

Twórcy

autor

Singh N.

autor

Lee H.

autor

Suh S.

autor

Kołaski M.

autor

Kim K.

Center for Superfunctional Materials, Department of Chemistry, Pohang University of Science and Technology, San 31, Hyojadong, Namgu, Pohang 790-784, Korea, kim@postech.ac.kr

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