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Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dyspr...

Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dyspr...

https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_plos_journals_1977445977

Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dysprosium, holmium and erbium

About this item

Full title

Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dysprosium, holmium and erbium

Publisher

United States: Public Library of Science

Journal title

PloS one, 2014-01, Vol.9 (1), p.e86376-e86376

Language

English

Formats

Publication information

Publisher

United States: Public Library of Science

More information

Scope and Contents

Contents

Complexes of dysprosium, holmium, and erbium find many applications as single-molecule magnets, as contrast agents for magnetic resonance imaging, as anti-cancer agents, in optical telecommunications, etc. Therefore, the development of tools that can be proven helpful to complex design is presently an active area of research. In this article, we ad...

Alternative Titles

Full title

Semiempirical quantum chemistry model for the lanthanides: RM1 (Recife Model 1) parameters for dysprosium, holmium and erbium

Identifiers

Primary Identifiers

Record Identifier

TN_cdi_plos_journals_1977445977

Permalink

https://devfeature-collection.sl.nsw.gov.au/record/TN_cdi_plos_journals_1977445977

Other Identifiers

ISSN

1932-6203

E-ISSN

1932-6203

DOI

10.1371/journal.pone.0086376

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