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1.
14 p, 3.0 MB Virtual assessment achieved two binary cocrystals based on a liquid and a solid pyridine derivative with modulated thermal stabilities / Ejarque, Daniel (Universitat Autònoma de Barcelona. Departament de Química) ; Calvet, Teresa (Universitat de Barcelona. Departament de Mineralogia, Petrologia i Geologia Aplicada) ; Font-Bardia, Mercè (Universitat de Barcelona. Centres Científics i Tecnològics de la Universitat de Barcelona) ; Pons Picart, Josefina (Universitat Autònoma de Barcelona. Departament de Química)
The rational design of cocrystals triggered by the control of recurrent H-bonded patterns referred to as supramolecular synthons enabled the correlation between their structure and properties, which has been a topic of interest owing to the possibility to modulate them depending on the selected components. [...]
2023 - 10.1039/d3ce00608e
CrystEngComm, Vol. 25, Issue 34 (September 2023) , p. 4798-4811  
Registre complet - Creative Commons
2.
6 p, 1.1 MB A Hg(i) corrugated sheet assembled by auxiliary dioxole groups and Hg⋯π interactions / Sánchez Férez, Francisco (Universitat Autònoma de Barcelona. Departament de Química) ; Solans Monfort, Xavier (Universitat Autònoma de Barcelona. Departament de Química) ; Calvet, Teresa (Universitat de Barcelona. Departament de Mineralogia, Petrologia i Geologia Aplicada) ; Font-Bardia, Mercè (Universitat de Barcelona. Centres Científics i Tecnològics) ; Pons Picart, Josefina (Universitat Autònoma de Barcelona. Departament de Química)
The formation of a new double-stranded staircase Hg(i) supramolecular assembly is reported. It is arranged into 2D corrugated sheets supported by Hg(i)⋯Odioxole and Hg⋯π interactions, resulting from the comproportionation reaction between Hg(ii) and Hg(0) species in DMF as a solvent.
2022 - 10.1039/d2ce00347c
CrystEngComm, Vol. 24, Issue 24 (June 2022) , p. 4351-4355  
Registre complet -
3.
10 p, 3.2 MB Thermal conductivity of epitaxially grown InP : experiment and simulation / Jaramillo Fernández, Juliana (Royal Institute of Technology KTH. Department of Material and Nano Physics) ; Chávez Ángel, Emigdio (Institut Català de Nanociència i Nanotecnologia) ; Sanatinia, Reza (Harvard University. John A. Paulson School of Engineering and Applied Sciences) ; Kataria, Himanshu (IRnova AB) ; Anand, Srinivasan (Royal Institute of Technology KTH. Department of Material and Nano Physics) ; Lourdudoss, Sebastian (Royal Institute of Technology KTH. Department of Material and Nano Physics) ; Sotomayor Torres, Clivia M. (Institut Català de Nanociència i Nanotecnologia)
The integration of III-V optoelectronic devices on silicon is confronted with the challenge of heat dissipation for reliable and stable operation. A thorough understanding and characterization of thermal transport is paramount for improved designs of, for example, viable III-V light sources on silicon. [...]
2017 - 10.1039/c6ce02642g
CrystEngComm, Vol. 19, Issue 14 (February 2017) , p. 1879-1887  
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4.
16 p, 2.2 MB Pyridine-driven assembly of Zn(II) and Cd(II) complexes with 2-furoic acid. The role of water in a structural transformation / Ejarque, Daniel (Universitat Autònoma de Barcelona. Departament de Química) ; Sánchez Férez, Francisco (Universitat Autònoma de Barcelona. Departament de Química) ; Félez-Guerrero, Núria (Universitat Autònoma de Barcelona. Departament de Química) ; Calvet, Teresa (Universitat de Barcelona. Departament de Mineralogia, Petrologia i Geologia Aplicada) ; Font-Bardia, Mercè (Centres Científics i Tecnològics de la Universitat de Barcelona (CCiTUB). Unitat de Difracció de Raig-X) ; Pons Picart, Josefina (Universitat Autònoma de Barcelona. Departament de Química)
Understanding the factors governing the self-assembly of organic ligands with metal ions is essential to engineering target molecular arrangements with the desired properties. Indeed, small modifications of the synthetic conditions lead to the obtention of different complexes, varying from discrete monomers to coordination polymers (CPs). [...]
2023 - 10.1039/D3CE00104K
CrystEngComm, Vol. 25, Issue 18 (May 2023) , p. 2739-2754  
Registre complet - Creative Commons
5.
9 p, 357.9 KB Systematic study of the impact of MOF densification into tablets on textural and mechanical properties / Dhainaut, Jérémy (Université Claude Bernard Lyon 1) ; Camur, Ceren (Institut Català de Nanociència i Nanotecnologia) ; Troyano, Javier (Institut Català de Nanociència i Nanotecnologia) ; Legrand, Alexandre (Institut Català de Nanociència i Nanotecnologia) ; Canivet, J. (Université Claude Bernard Lyon 1) ; Imaz, Inhar (Institut Català de Nanociència i Nanotecnologia) ; Maspoch Comamala, Daniel (Institut Català de Nanociència i Nanotecnologia) ; Reinsch, Helge (MOFapps) ; Farrusseng, David (Université Claude Bernard Lyon 1)
Four different metal-organic framework powders (UiO-66, UiO-66-NH, UiO-67, and HKUST-1) were shaped into tablets. The effect of the applied pressure on porous properties, mechanical resistance and tablet bulk density is reported. [...]
2017 - 10.1039/c7ce00338b
CrystEngComm, Vol. 19, issue 29 (August 2017) , p. 4211-4218  
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6.
10 p, 1.1 MB Two-step synthesis of heterometallic coordination polymers using a polyazamacrocyclic linker / Aríñez Soriano, Javier (Institut Català de Nanociència i Nanotecnologia) ; Albalad, Jorge (Institut Català de Nanociència i Nanotecnologia) ; Pérez-Carvajal, Javier (Institut Català de Nanociència i Nanotecnologia) ; Imaz, Inhar (Institut Català de Nanociència i Nanotecnologia) ; Busqué Sánchez, Félix (Universitat Autònoma de Barcelona. Departament de Química) ; Juanhuix, Judith (ALBA Laboratori de Llum de Sincrotró) ; Maspoch Comamala, Daniel (Institut Català de Nanociència i Nanotecnologia)
A new macrocyclic linker 1,4,7,10-tetraazacyclododecane-1,7-bis(4-acetamidobenzoic)-4,10-diacetic acid (HL1) was synthesized and characterized. This linker was used to create two heterometallic coordination polymers following a two-step synthesis. [...]
2016 - 10.1039/c5ce02520f
CrystEngComm, Vol. 18, Issue 22 (June 2016) , p. 4196-4204  
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7.
9 p, 1.4 MB Controllable vapor phase fabrication of F:Mn3O4 thin films functionalized with Ag and TiO2 / Bigiani, Lorenzo (Università degli studi di Padova. Dipartimento di Scienze Chimiche) ; Barreca, Davide (Università degli studi di Padova. Dipartimento di Scienze Chimiche) ; Gasparotto, Alberto (Università degli studi di Padova. Dipartimento di Scienze Chimiche) ; Sada, Cinzia (Università degli studi di Padova. Dipartimento di Fisica e Astronomia) ; Martí-Sánchez, Sara (Institut Català de Nanociència i Nanotecnologia) ; Arbiol i Cobos, Jordi (Institut Català de Nanociència i Nanotecnologia) ; Maccato, Chiara (Università degli studi di Padova. Dipartimento di Scienze Chimiche)
A facile two-step vapor phase synthetic approach is proposed for the fabrication of MnO thin films chemically modified with fluorine, and eventually functionalized with silver or titania. The adopted strategy exploits the initial chemical vapor deposition (CVD) of MnO on Si(100) substrates starting from a diamine diketonate Mn(ii) complex, followed by the controlled radio frequency (RF)-sputtering of silver or titania. [...]
2018 - 10.1039/c8ce00387d
CrystEngComm, Vol. 20, Issue 22 (June 2018) , p. 3016-3024  
Registre complet -
8.
6 p, 2.2 MB A combinatorial study of the mechanical and magnetic properties of a gradually nitrided austenitic stainless steel single crystal / Menéndez Dalmau, Enric (Institut Català de Nanociència i Nanotecnologia) ; Templier, C. (Université de Poitiers. Institut Pprime) ; Abrasonis, G. (Das Helmholtz-Zentrum Dresden-Rossendorf. Institut für Ionenstrahlphysik und Materialforschung) ; López-Barbera, José Francisco (Institut Català de Nanociència i Nanotecnologia) ; Nogués, Josep (Institut Català de Nanociència i Nanotecnologia) ; Temst, Kristiaan (Instituut voor Kern- en Stralingsfysica. KU Leuven) ; Sort Viñas, Jordi (Universitat Autònoma de Barcelona. Departament de Física)
The mechanical and magnetic properties of a nitrided austenitic stainless steel are studied using a combinatorial approach. Plasma nitriding of a [100]-oriented 316L single crystal is carried out using a loose shadow mask to produce an in-plane lateral gradient of nitrogen concentration that extends up to 100 μm. [...]
2014 - 10.1039/c3ce42379d
CrystEngComm, Vol. 16, issue 17 (May 2014) , p. 3515-3520  
Registre complet - Creative Commons

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