nonadiabatic coupling
Nonadiabatic coupling of the dynamical structure to the superconductivity in YSr2Cu2.75Mo0.25O7.54 and Sr2CuO3.3
... The coupling of the super- conductivity to the iqtp that originates in this nonadiabatic coupling between the electrons and lattice demonstrates an important role for the dynamical structure whereby ...
9
Sequential nonadiabatic excitation of large molecules and ions driven by strong laser fields
... @7,8#. Nonadiabatic molecule-laser interaction results in all other possible outcomes, such as nonresonant electronic excitation @9#, internal conversion @10,11#, fragmentation to neutral products @3#, ...
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Nonadiabatic Dynamics of Cycloparaphenylenes with TD-DFTB Surface Hopping
... in nonadiabatic couplings ...for nonadiabatic coupling computations on the same ...processor. Nonadiabatic couplings were computed in both simulations with the overlap derivative ...of ...
39
Multielectron effects and nonadiabatic electronic dynamics in above threshold ionization and high-harmonic generation
... The nonadiabatic coupling mixes the ionic states on sub-cycle timescales as the ATI electron is leaving the core, and thus the ATI electrons carry signatures of both ionization potentials, resulting in a ...
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Site-selective isomerization of cyano-substituted butadienes: chemical control of nonadiabatic dynamics
... E-mail: michael.schuurman@nrc-cnrc.gc.ca 1 Spawning As per the original definition of FMS on adiabtic surfaces, 1 a spawning event occurs when the dot product of the nonadiabatic coupling vector d and the ...
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Nonadiabatic dynamics of polyatomic molecules and ions in strong laser fields
... highly nonadiabatic coupling regime, resulting in the rapid onset of extensive fragmentation of a ...comprising nonadiabatic ionization of a neutral molecule and subsequent energy deposition in the ...
5
Coupling approach in building physics.
... On the other hand, the second approach gives very precise results but it is impossible to realize long term studies due to numerical resources. Indeed, it takes several hours to obtain results in one configuration but it ...
1
Ventriculo-arterial coupling- Hemodynamic basics
... • Medical and Coronary Intensive Care Unit, Internal Medicine Department, University Hospital of Liège. Pironet[r] ...
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On-surface coupling reactions on calcium carbonate
... 47 Figure 2.17 Mechanistic sketch of concatenate Sonogashira-Glaser coupling reaction from ref. 22 . In the same paper the authors show the influence of precatalysts in the Glaser-Hay coupling step. When ...
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Cobalt-Catalyzed C-C and C-N Coupling reactions
... reductive coupling, possibly by facilitating reduction of the nickel catalyst 73 or the formation of a nickelate ...The coupling perhaps occurs after the alkyl substrates (alkyl chlorides, mesylates or ...
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Coupling Optiview and Production Simulation
... The production simulation is very effective for the modelling of the human and transport resources like the gantry crane movements while OptiView is very powerful for the allocation of[r] ...
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Contribution of nonadiabatic ions to the cross-tail current in an O+ dominated thin current sheet
... of nonadiabatic motion in the ions, and to deter- mine how much these ions contribute to the cross-tail ...of nonadiabatic ion motion were observed when the current sheet was sufficiently ...
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Iron-Catalyzed Aryl-Aryl Cross-Coupling Reaction: Homo-versus Hetero-Coupling Reactions
... experimental results, including 1 H paramagnetic NMR and 57 Fe-Mössbauer spectroscopies. 3 These results enlighten the mechanistic features of iron-catalyzed Grignard oxidative homocoupling, and can provide guidance in ...
2
MOMA GC-MS Coupling
... Instrumental Suite: The French brassboard GC coupled has been coupled to the US brassboard ion trap mass spectrometer in a flight-like configuration (fig 1) for the coupling campaign. The MOMA GC setup is based on ...
3
Coupling, Reinforcement, and Speciation
... and coupling does not occur ...adaptive coupling of existing barrier effects ( ...by-product coupling pro- cesses because selection acts directly to cause ...fitness, coupling can be consid- ...
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Au(I)/Au(III)-Catalyzed C-N Coupling
... C‒N coupling product (Figure 3c), (ii) under the optimized catalytic reactions, its activity is very similar to that of the (MeDalphos)Au(I) + complex (Figure ...
7
Frequency Locking in Tissular Coupling
... tissular coupling, is based on a quite general vision of complex systems: they are constituted of interacting subsystems, named ...tissular coupling is a quite general object as the number of cell is not ...
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The Particle-Vibration Coupling Form Factor
... calculations we made for the dipole and quadrupole vibrations. Our purpose here is threefold. Firstly, we want to give the derivation of the expression of the for[r] ...
8
Electrokinetic coupling in unsaturated porous media
... 6 . Numerical Simulations To illustrate the model developed in the previous sections, we simulate numerically a primary drainage and secondary imbibition experiment of a horizontal sand column. This simulation will ...
46
Coupling proofs are probabilistic product programs
... a coupling and does not give a way to prove quantitative properties about the coupling, which are need to reason about mixing and convergence of probabilistic ...
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