---
title: "Magnetism, Chemical Bonding and Hyperfine Properties in the Nanoscale Antiferromagnet <math>[Fe(OMe)2(O2 CCH2 Cl)]10</math> • CBPF Index"
description: "CBPF INDEX is the system that tracks the scientific and technological output of CBPF. It lists the articles, books, technical reports and other publications of the whole CBPF community."
canonical_url: "https://index.cbpf.br/en/publicacoes/6ad2a767639f62b11adbb89b"
locale: en
meta:
  "og:description": "CBPF INDEX is the system that tracks the scientific and technological output of CBPF. It lists the articles, books, technical reports and other publications of the whole CBPF community."
  "og:image": "https://index.cbpf.br/_og/d/c_Item%2Ctitulo_~TWFnbmV0aXNtLCBDaGVtaWNhbCBCb25kaW5nIGFuZCBIeXBlcmZpbmUgUHJvcGVydGllcyBpbiB0aGUgTmFub3NjYWxlIEFudGlmZXJyb21hZ25ldCA8bWF0aD5bRmUoT01lKTIoTzIgQ0NIMiBDbCldMTA8L21hdGg-%2Ctipo_Physics%2BNote%2Ccor_~I2E4MmMwMA%2Cautores_~Wi4gWmVuZzsgWS4gRHVhbjsgRC4gR3VlbnpidXJnZXI%2Cdetalhe_1996%2Csecao_Publications%2Cp_Ii9lbi9wdWJsaWNhY29lcy82YWQyYTc2NzYzOWY2MmIxMWFkYmI4OWIi%2Cs_ArqrrQXt6-4m6rkd.png"
  "og:image:height": "600"
  "og:image:type": image/png
  "og:image:width": "1200"
  "og:title": "Magnetism, Chemical Bonding and Hyperfine Properties in the Nanoscale Antiferromagnet <math>[Fe(OMe)2(O2 CCH2 Cl)]10</math> • CBPF Index"
  "twitter:image": "https://index.cbpf.br/_og/d/c_Item%2Ctitulo_~TWFnbmV0aXNtLCBDaGVtaWNhbCBCb25kaW5nIGFuZCBIeXBlcmZpbmUgUHJvcGVydGllcyBpbiB0aGUgTmFub3NjYWxlIEFudGlmZXJyb21hZ25ldCA8bWF0aD5bRmUoT01lKTIoTzIgQ0NIMiBDbCldMTA8L21hdGg-%2Ctipo_Physics%2BNote%2Ccor_~I2E4MmMwMA%2Cautores_~Wi4gWmVuZzsgWS4gRHVhbjsgRC4gR3VlbnpidXJnZXI%2Cdetalhe_1996%2Csecao_Publications%2Cp_Ii9lbi9wdWJsaWNhY29lcy82YWQyYTc2NzYzOWY2MmIxMWFkYmI4OWIi%2Cs_ArqrrQXt6-4m6rkd.png"
---

> Index of every page on this site: [llms.txt](https://index.cbpf.br/llms.txt)

**Physics Note****Published**

# **Magnetism, Chemical Bonding and Hyperfine Properties in the Nanoscale Antiferromagnet **<math>\[Fe(OMe)2(O2CCH2Cl)]10</math>\<math>\[Fe(OMe)\_2(O\_2 CCH\_2 Cl)]\_{10}\</math><math>\[Fe(OMe)2​(O2​CCH2​Cl)]10​</math>

**Z. Zeng; Y. Duan; D. Guenzburger**

1996

[**Download PDF **1 MB](https://index.cbpf.br/files/publicacao/6ad2a767639f62b11adbb89b/pdf) [**Contact owner**](<mailto:apub@cbpf.br?subject=Magnetism%2C%20Chemical%20Bonding%20and%20Hyperfine%20Properties%20in%20the%20Nanoscale%20Antiferromagnet%20%3Cmath%3E%5BFe(OMe)2(O2%20CCH2%20Cl)%5D10%3C%2Fmath%3E>)

## **Publication details**

<dl>

<dt>Authors</dt>
<dd>Z. Zeng; Y. Duan; D. Guenzburger</dd>

<dt>Type</dt>
<dd>Physics Note</dd>

<dt>Status</dt>
<dd>Published</dd>

<dt>Publication date</dt>
<dd>1996</dd>

<dt>Description</dt>
<dd>The electronic and magnetic properties of the nanometer-size antiferromagnet &lt;math&gt;[Fe(OMe)_2(O_2 CCH_2 Cl)]_{10}\,\!&lt;/math&gt; (the "ferric wheel" molecule) are investigated with the first-principles spin-polarized Discrete Variational Method, in the framework of Density Functinal theory. Magnetic moments, densities of states and charge and spin-density maps are obtained. The Mössbauer hyperfine parameters Isomer shift, Quadrupole Splitting and Hyperfine Field are obtained from the calculations and compared to reported experimental values when available.</dd>

<dt>Year</dt>
<dd>1996</dd>

<dt>Number</dt>
<dd>CBPF-NF-060/96</dd>

<dt>Linked to a thesis</dt>
<dd>No</dd>

<dt>Linked to a grant</dt>
<dd>No</dd>

</dl>

```json
{"@context":"https://schema.org","@graph":[{"@id":"https://index.cbpf.br/en#website","@type":"WebSite","description":"O CBPF INDEX é o sistema de acompanhamento da produção científica e tecnológica do CBPF. Nele é possível obter a lista de publicações de artigos, livros, relatórios técnicos, etc de toda a comunidade do CBPF.","inLanguage":"en-US","name":"CBPF Index","url":"https://index.cbpf.br/en","publisher":{"@id":"https://index.cbpf.br/#identity"},"translationOfWork":{"@id":"https://index.cbpf.br/#website"}},{"@id":"https://index.cbpf.br/en/publicacoes/6ad2a767639f62b11adbb89b#webpage","@type":"WebPage","description":"CBPF INDEX is the system that tracks the scientific and technological output of CBPF. It lists the articles, books, technical reports and other publications of the whole CBPF community.","name":"Magnetism, Chemical Bonding and Hyperfine Properties in the Nanoscale Antiferromagnet \u003Cmath>[Fe(OMe)2(O2 CCH2 Cl)]10\u003C/math>","url":"https://index.cbpf.br/en/publicacoes/6ad2a767639f62b11adbb89b","isPartOf":{"@id":"https://index.cbpf.br/en#website"},"potentialAction":[{"@type":"ReadAction","target":["https://index.cbpf.br/en/publicacoes/6ad2a767639f62b11adbb89b"]}],"primaryImageOfPage":{"@id":"https://index.cbpf.br/#logo"}},{"@id":"https://index.cbpf.br/#identity","@type":"Organization","alternateName":"CBPF","description":"Unidade de pesquisa do Ministério da Ciência, Tecnologia e Inovação dedicada à pesquisa básica em Física, suas aplicações e à formação científica.","email":"web@cbpf.br","legalName":"Centro Brasileiro de Pesquisas Físicas/CBPF","name":"Centro Brasileiro de Pesquisas Físicas","taxID":"04.044.443/0001-35","telephone":"+55-21-2141-7100","url":"https://cbpf.br","address":{"@type":"PostalAddress","streetAddress":"Rua Dr. Xavier Sigaud, 150","addressLocality":"Rio de Janeiro","addressRegion":"RJ","postalCode":"22290-180","addressCountry":"BR"},"logo":{"@id":"https://index.cbpf.br/#logo"},"sameAs":["https://twitter.com/cbpf_mcti"]},{"@id":"https://index.cbpf.br/#logo","@type":"ImageObject","caption":"Centro Brasileiro de Pesquisas Físicas","contentUrl":"https://index.cbpf.br/icon-512x512-light.png","inLanguage":"en-US","url":"https://index.cbpf.br/icon-512x512-light.png"}]}
```

## Sitemap

See the full [sitemap](https://index.cbpf.br/sitemap.md) for all pages.