The forward problem for the electromagnetic Helmholtz equation

157 p.

Procedimiento de refutación para un conjunto de restricciones sobre documentos XML

We present a prototype that implements a set of logical rules to prove the satis ability for a class of speci cations on XML documents. Speci cations are given by means of constraints built on Boolean XPath patterns. The main goal of this tool is to test if a given speci cation is satis able or not, showing the history of the execution. It can also be used to test if a given document is a model of a given speci cation and, as a subproduct, it allows to look for all the relations (monomorphisms) between two patterns or the result of doing some operations by combining patterns in di erent ways. The results of these operations are visually shown and therefore the tool makes these operations more understandable. The implementation of the algorithm has been written in Prolog but the prototype has a Java interface for an easy and friendly use.

Synthesis and structural characterisation of [Cu2[(PDC)2(bpa)(H2O)2]•nH2O•mDMF (n=3 and m=1 for 1, n=7 and m=0 for 2, PDC=2,5-pyrindinedicarboxylate and bpa= 1,2-di(4-pyridil)ethane))

[EN] Combination of polycarboxylate anions and dipyridyl ligands is an effective strategy to produce solid coordination frameworks (SCF) which are crystalline materials based on connections between metal ions through organic ligands. In this sense, combination of polycarboxylate anions and dipyridyl ligands is an effective strategy to produce extended structures. In this context, this work is focused on two novel CuII-based SCFs exhibiting PDC (2,5-pyridinedicarboxylate) and bpa (1,2-di(4-pyridyl)ethane), being the first structures reported in literature containing both ligands. Chemical formula are [Cu2[(PDC)2(bpa)(H2O)2]•3H2O•DMF (1), and [Cu2(PDC)2(bpa)(H2O)2]•7H2O (2), where DMF is dimethylformamide. Compounds 1 and 2 have been characterized by means of XRD, IR, TG/DTG, and DTA analysis.

Embedding quantum simulators

79 p.

MOFs basados en CuII-PDC-bpe (PDC= 2,5-piridindicarboxilato, bpe= 1,2-di(4piridil)eteno): Cristaloquímica de redes 2D tipo Herringbone

Comunicación a congreso (póster): XXIV Simposio del Grupo Especializado de Cristalografía y Crecimiento Cristalino, GE3C. 23-26 de junio de 2014, Bilbao