UAB Digital Repository of Documents 2 records found  Search took 0.02 seconds. 
1.
5 p, 1.9 MB Heat transport through a solid-solid junction : The interface as an autonomous thermodynamic system / Rurali, Riccardo (Institut de Ciència de Materials de Barcelona) ; Colombo, Luciano (Institut Català de Nanociència i Nanotecnologia) ; Cartoixà Soler, Xavier (Universitat Autònoma de Barcelona. Departament d'Enginyeria Electrònica) ; Øivind, Wilhelmsen (SINTEF Energy Research) ; Trinh, Thuat T. (Norwegian University of Science and Technology. Department of Chemistry) ; Bedeaux, Dick (Norwegian University of Science and Technology. Department of Chemistry) ; Kjelstrup, Signe (Norwegian University of Science and Technology. Department of Chemistry)
We perform computational experiments using nonequilibrium molecular dynamics simulations, showing that the interface between two solid materials can be described as an autonomous thermodynamic system. [...]
2016 - 10.1039/c6cp01872f
Physical chemistry chemical physics, Vol. 18, Issue 20 (May 2016) , p. 13741-13745  
2.
9 p, 3.2 MB Early events in the photochemistry of 5-diazo Meldrum's acid : Formation of a product manifold in C-N bound and pre-dissociated intersection seam regions / Li, Huijing (Beijing Institute of Technology. School of Chemistry and Chemical Engineering) ; Migani, Annapaola (Institut Català de Nanociència i Nanotecnologia) ; Blancafort, Lluís (Institut de Química Computacional i Catàlisi) ; Li, Quansong (Beijing Institute of Technology. School of Chemistry and Chemical Engineering) ; Li, Zesheng (Beijing Institute of Technology. School of Chemistry and Chemical Engineering)
5-Diazo Meldrum's acid (DMA) undergoes a photo-induced Wolff rearrangement (WR). Recent gas-phase experiments have identified three photochemical products formed in a sub-ps scale after irradiation, a carbene formed after nitrogen loss, a ketene formed after WR and a second carbene formed after nitrogen and CO elimination (A. [...]
2016 - 10.1039/c6cp06290c
Physical chemistry chemical physics, Vol. 18, Issue 44 (November 2016) , p. 30785-30793  

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