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91.
Dr. Martín Amoza Dr. Lindley Maxwell Prof. Núria Aliaga-Alcalde Dr. Silvia Gómez-Coca Prof. Eliseo Ruiz 《Chemistry (Weinheim an der Bergstrasse, Germany)》2021,27(66):16440-16447
We report the spin dynamic properties of non-substituted ferrocenium complexes. Ferrocenium shows a field-induced single-molecule magnet behaviour in DMF solution while cobaltocene lacks slow spin relaxation neither in powder nor in solution. Multireference quantum mechanical calculations give a non-Aufbau orbital occupation for ferrocenium with small first excitation energy that agrees with the relatively large measured magnetic anisotropy for a transition metal S=1/2 system. The analysis of the spin relaxation shows an important participation of quantum tunnelling, Raman, direct and local-mode mechanisms which depend on temperature and the external field conditions. The calculation of spin-phonon coupling constants for the vibrational modes shows that the first vibrational mode, despite having a low spin-phonon constant, is the most efficient process for the spin relaxation at low temperatures. In such conditions, vibrational modes with higher spin-phonon coupling constants are not populated. Additionally, the vibrational energy of this first mode is in excellent agreement with the experimental fitted value obtained from the local-mode mechanism. 相似文献
92.
do Nascimento Hederson Majela dos Santos Andressa Duarte Vitor Anthony Bittencourt Paulo Rodrigo Stival Radovanovic Eduardo Fávaro Silvia Luciana 《Cellulose (London, England)》2021,28(9):5477-5492
Cellulose - In this work lignocellulosic fibers were obtained from Yucca aloifolia L. leaves and their chemical, morphological, thermal and mechanical properties were studied. The fibers were... 相似文献
93.
94.
Lodi Andrea Nap Cees-Jan Metzger-Maurer Silvia Schwartzenberger Christelle 《Accreditation and quality assurance》2018,23(4):211-218
Accreditation and Quality Assurance - Two approaches were used to determine the mass fraction of a sample of folic acid, one indirect (mass balance) where the components other than folic acid were... 相似文献
95.
96.
Nontrivial Solutions for p-Laplace Equations with Right-Hand Side Having p-Linear Growth at Infinity
Silvia Cingolani 《偏微分方程通讯》2013,38(8):1191-1203
ABSTRACT The existence of a nontrivial solution for quasi-linear elliptic equations involving the p-Laplace operator and a nonlinearity with p-linear growth at infinity is proved. Techniques of Morse theory are employed. 相似文献
97.
Silvia Dulanská Boris Remenec Ján Bilohuštin Miroslav Labaška Dušan Galanda 《Journal of Radioanalytical and Nuclear Chemistry》2013,295(3):2189-2192
This paper describes the use of IBC’s AnaLig® Sr-01 molecular recognition technology product to effectively and selectively pre-concentrate, separate, and recover strontium from urine samples. This method uses two-stage columns separation consisting of two different commercial products Eichrom’s Pre-filter Material and AnaLig® Sr-01 column from IBC Advanced Technologies. This method does not involve co-precipitation of strontium as phosphates and oxalates from urine samples. The new rapid method separates strontium-90 with high chemical recovery. 相似文献
98.
Gabriella Ieronimo Alessandro Mondelli Francesco Tibiletti Angelo Maspero Giovanni Palmisano Simona Galli Stefano Tollari Norberto Masciocchi Kenneth M. Nicholas Silvia Tagliapietra Giancarlo Cravotto Andrea Penoni 《Tetrahedron》2013
The thermal reaction between nitrosoarenes and alkynes under alkylating conditions produces N-alkoxyindoles as the major products in moderate to good yields and excellent regioselectivity. Various electrophiles are used affording different N–O-protected hydroxyindoles in a multi-component fashion. Privileged acetylenic substrates used in reactions with substituted nitrosoarenes are arylalkynes or propiolates. Potentially bioactive compounds and other classes of highly functionalizable indole products were prepared. Reactions between o-carbomethoxy-nitrosoarenes and arylacetylenes provided tricyclic compounds containing an acylaziridine indoline skeleton. 相似文献
99.
Matthias Otto Müller Stefan N. Groesser Silvia Ulli-Beer 《European Journal of Operational Research》2012,216(2):495-502
Collaborative research, defined as research involving actors participating in the problem situation under study, has an important role in operational research, strategic management and systems thinking. In a recent study, we found that a strong organizational focus incorporated into many soft operational research (OR) approaches is inadequate for studying societal problem situations, which are fragmented and have no clear boundary. Specifically, we failed to find a process of identifying individuals that is capable of representing the perspectives of actors and sufficient for research into societal problem situations. We found no clear terminology accounting for ontological differences between actors, individuals representing them and conceptual representations of acting entities. In response to this gap in the literature, we propose terminology that differentiates among actors (individuals or collective entities in the real world), experts (individuals capable of representing the perspective of an actor) and agents (ideal-typical representations of actors). Based on this terminology, we propose an iterative method to guide the assembly of an expert group to undertake collaborative research into societal problem situations. To demonstrate the application of our method, we present selected insights from our study in an electronic supplement. 相似文献