Towards and ab initio description of magnetism in ionic solids

The physical contributions to the KNiF3 magnetic exchange coupling integral have been obtained from specially designed ab initio cluster model calculations. Three important mechanisms have been identified. These are the delocalization of the magnetic orbitals into the anion p band, the variational contribution of the second-order interactions, and the many-body terms hidden in the two-body operator and the Heisenberg Hamiltonian.

A first-principles analysis of the magnetism of CuII polynuclear coordination complexes: the case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4·2.5H2O

The magnetic structure of the [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4·2.5 H2Ocrystal - using fractional coordinates determined at room-temperature ¿ has beenanalysed in detail. This analysis has been carried out by extending our first principlesbottom-up theoretical approach, which was initially designed to study through-spacemagnetic interactions, to handle through-bond magnetic interactions. The only input datarequired by this approach are the values of the computed JAB exchange parameters for allthe unique pairs of spin-containing centres. The results allow the magnetic structure ofthe crystal, which presents two types of isolated tetranuclear CuII clusters, to be definedin quantitative terms. Each of these clusters presents ferro and antiferromagneticinteractions, the former being stronger, although outnumbered by the latter. Thecomputed magnetic susceptibility curve shows the same qualitative features as theexperimental data. However, there are small differences that are presumed to beassociated with the use of room-temperature crystal coordinates.

Animal Toxins: How is Complexity Represented in Databases?

Peptide toxins synthesized by venomous animals have been extensively studied in the last decades. To be useful to the scientific community, this knowledge has been stored, annotated and made easy to retrieve by several databases. The aim of this article is to present what type of information users can access from each database. ArachnoServer and ConoServer focus on spider toxins and cone snail toxins, respectively. UniProtKB, a generalist protein knowledgebase, has an animal toxin-dedicated annotation program that includes toxins from all venomous animals. Finally, the ATDB metadatabase compiles data and annotations from other databases and provides toxin ontology.

A first-principles analysis of the magnetism of CuII polynuclear coordination complexes: the case of [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4·2.5H2O

The magnetic structure of the [Cu4(bpy)4(aspartate)2(H2O)3](ClO4)4·2.5 H2Ocrystal - using fractional coordinates determined at room-temperature ¿ has beenanalysed in detail. This analysis has been carried out by extending our first principlesbottom-up theoretical approach, which was initially designed to study through-spacemagnetic interactions, to handle through-bond magnetic interactions. The only input datarequired by this approach are the values of the computed JAB exchange parameters for allthe unique pairs of spin-containing centres. The results allow the magnetic structure ofthe crystal, which presents two types of isolated tetranuclear CuII clusters, to be definedin quantitative terms. Each of these clusters presents ferro and antiferromagneticinteractions, the former being stronger, although outnumbered by the latter. Thecomputed magnetic susceptibility curve shows the same qualitative features as theexperimental data. However, there are small differences that are presumed to beassociated with the use of room-temperature crystal coordinates.

Iowa Animal Industry News, 2012, Vol. 14, no. 1

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa.Previously titled Animal Industry News.

Iowa Animal Industry News, January 7, 2011, Vol. 11, no. 1

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa. Previously titled Animal Industry News.

Iowa Animal Industry News, January 20, 2011, Vol. 11, no. 2

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa. Previously titled Animal Industry News.

Iowa Animal Industry News, March 4, 2011, Vol. 11, no. 4

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa. Previously titled Animal Industry News.

Iowa Animal Industry News, February 4, 2011, Vol. 11, no. 3

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa. Previously titled Animal Industry News. Previously titled Animal Industry News.

Iowa Animal Industry News, 2013, Vol. 14, no. 1

Newsletter produced by Department of Agriculture and Land Stewardship about the animal industry in Iowa. Previously titled Animal Industry News.

Determinação da composição mineral de subprodutos agroindustriais utilizados na alimentação animal, pela técnica de ativação neutrônica

O presente trabalho teve como objetivo analisar alguns subprodutos agroindustriais utilizados na alimentação animal e identificar os principais minerais presentes. Amostras de farelos de algodão, arroz, canola, soja e trigo; farinhas de peixe, carne e penas + vísceras; cascas de algodão, arroz, laranja; bagaços de tomate e de laranja foram coletadas em diferentes locais de produção. O método analítico empregado foi a análise por ativação com nêutrons seguida de espectrometria gama. Os níveis de minerais encontrados em todas as amostras, inclusive aqueles considerados tóxicos, tais como As, Cd e Hg, não excederam os limites máximos permitidos em dietas para animais domésticos. Os valores obtidos foram comparados com os comumente encontrados em forragens.

PRODUÇÃO ANIMAL EM PASTAGEM DE MILHETO SOB DIFERENTES NÍVEIS DE NITROGÊNIO

O experimento foi conduzido em área da Universidade Federal de Santa Maria, RS, com o objetivo de verificar os efeitos de três níveis de adubação nitrogenada (0, 150 e 300 kg/ha de N) em pastagem de milheto (Pennisetum americanum (L.) Leeke) cv. Comum, sobre a produção animal. Foram utilizados novilhos de corte e avaliados o desempenho por animal, o número de animais.dia/ha e o ganho de peso vivo por área. O sistema de pastejo adotado foi o contínuo, com ajustes de carga para manter uma pressão de pastejo de 10%, caracterizando um resíduo médio de 3.168 kg de matéria seca/ha. As variáveis dependentes mostraram relação linear positiva com os níveis de adubação nitrogenada, o que denota o alto potencial do milheto.