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Quantum-classical correspondence and the role of the dipole function in molecular dissociation
(Elsevier B.V., 2014-07-18)
We consider the quantum and classical dissociation dynamics of heteronuclear diatomic molecules induced by infrared laser pulses. The field-molecule interaction is given by the product of the time-dependent electric field ...
Accurate Electron Affinities and Orbital Energies of Anions from a Nonempirically Tuned Range-Separated Density Functional Theory Approach
(American Chemical Society, 2017-04-24)
The treatment of atomic anions with Kohn-Sham density functional theory (DFT) has long been controversial because the highest occupied molecular orbital (HOMO) energy, EHOMO, is often calculated to be positive with most ...
Resource selection in an apex predator and variation in response to local landscape characteristics
(2018-12-01)
Habitat loss and fragmentation represent major threats for the conservation of apex predators, such as the jaguar (Panthera onca). Investigating species’ resource selection behavior in response to landscape alteration is ...
Hierarchical determinants of the functional richness, evenness and divergence of a vertebrate predator assemblage
(2009)
Environmental factors are hypothesized to affect the functional diversity of assemblages hierarchically. First, ecological filters constrain the range of functional traits potentially displayed by an assemblage by determining ...
Validação manual de proteínas identificadas por espectrometria de massas de Trypanosoma (Herpetosoma) rangeli
(Florianópolis, SC., 2018-11-26)
A abordagem proteômica com base em espectrometria de massa (MS/MS) vem sendo utilizada para identificar biomarcadores acoplada com outras técnicas proteômicas ou somadas aos marcadores bioquímicos tradicionais. Essa ...
Mapping a square by complex functions
(Wolfram Demonstration Project, 2016)
Mapping a square by complex functions
(Wolfram Demonstration Project, 2011)
On weighted inequalities for fractional integrals of radial functions
(Univ Illinois Urbana-champaign, 2011-05)
We prove a weighted version of the Hardy-Littlewood-So- bolev inequality for radially symmetric functions, and show that the range of admissible power weights appearing in the classical inequality due to Stein and Weiss ...