نتایج جستجو برای: inner transition elements

تعداد نتایج: 602988  

2018
Giampiero Amato

Several transition metals other than the largely used Cu and Ni can be, in principle, employed to catalyze carbon precursors for the chemical vapor deposition of graphene, because the thermodynamics of their alloying with carbon is well known. For example, the wealth of information in the Co-C phase diagram can be used to predict the properties of graphene grown in this way. It is, in fact, exp...

Journal: :Physical chemistry chemical physics : PCCP 2012
Roberto Peverati Donald G Truhlar

We report a new local exchange-correlation energy functional that has significantly improved across-the-board performance, including main-group and transition metal chemistry and solid-state physics, especially atomization energies, ionization potentials, barrier heights, noncovalent interactions, isomerization energies of large moleucles, and solid-state lattice constants and cohesive energies.

Journal: :Chemical communications 2015
N Bridonneau J Long J-L Cantin J von Bardeleben S Pillet E-E Bendeif D Aravena E Ruiz V Marvaud

Photo-induced spin transition in a molybdenum-zinc complex has been evidenced and fully characterized by Squid magnetometry and several spectroscopies performed under irradiation (IR, EPR, etc.). The phenomenon has been confirmed by X-ray diffraction and DFT calculations yielding a Light-Induced Excited Spin State Trapping Effect (LIESST) on a 4d transition metal ion.

2016
Haipan Zhu Peile Du Jianjun Li Ziyang Liao Guohua Liu Hao Li Wei Wang

A cooperative catalytic strategy of chiral iminium catalysis by regioselective activation of the C=C bond in enals and a transition metal promoting to open the 2-vinylcyclopropanes for highly regio- and enantioselective [3 + 2] cycloaddition reaction of 2-vinylcyclopropanes with α,β-unsaturated aldehydes has been developed.

2013
Young Hoon Lee Jack M. Harrowfield Jong Won Shin Mi Seon Won Elisabeth Rukmini Shinya Hayami Kil Sik Min Yang Kim

Use of Hirshfeld surfaces calculated from crystal structure determinations on various transition metal ion complexes of three terpyridine ligands carrying trimethoxyphenyl substituents has enabled an assessment of the contribution made by the ligand components to the interactions determining the lattice structures, interactions expected also to be present in metallomesogens derived from similar...

Journal: :Accounts of chemical research 2003
James K McCusker

Our research is concerned with the application of femtosecond time-resolved absorption techniques to the study of the photophysics of transition metal complexes. The focus is to understand the events that characterize the process of excited-state evolution from the time a photon is absorbed by a molecule to the formation of the lowest-energy excited state of the system. This Account describes o...

Journal: :Physical review letters 2008
J Walowski G Müller M Djordjevic M Münzenberg M Kläui C A F Vaz J A C Bland

We relate the energy dissipation processes at the femtosecond (electron-spin relaxation time tau el-sp) and nanosecond time scale (Gilbert relaxation taualpha) to the microscopic model proposed by Koopmans [Phys. Rev. Lett. 95, 267207 (2005)]. At both time scales, Elliot-Yafet scattering is proposed as the dominant contribution. We controllably manipulate the energy dissipation by transition me...

2015
Lorenzo Piola Fady Nahra Steven P Nolan

Since the discovery and now widespread use of olefin metathesis, the evolution of metathesis catalysts towards air stability has become an area of significant interest. In this fascinating area of study, beginning with early systems making use of high oxidation state early transition metal centers that required strict exclusion of water and air, advances have been made to render catalysts more ...

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