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Wyniki wyszukiwania dla: NaRb
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The adiabatic potentials of low-lying electronic states of the NaRb molecule
PublikacjaAdiabatic potential energy curves and spectroscopic constants have been calculated for the NaRb molecule. The results of ten states of the symmetry Σ+, six states of the symmetry Π, and two states of the symmetry Δ are obtained by the nonrelativistic quantum chemical method used with pseudopotentials describing the interaction of valence electrons with atomic cores. Analysis is based on a comparison with the results of other theoretical...
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Quasirelativistic potential energy curves and transition dipole moments of NaRb
PublikacjaWe report on extensive calculations of quasi-relativistic potential energy curves and, for the first time, transition dipole moments including spin-orbit and scalar-relativistic effects of the NaRb molecule. The calculated curves of the 0+, 0-, 1, 2 and 3 molecular states correlate for large internuclear separation with the fourteen lowest atomic energies up to the Na(3s ^2S_{1/2}) + Rb(7s ^2S_{1/2}) atomic limit. Several new features...
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Optimization of the femtosecond laser impulse for excitation and the Spin-Orbit mediated dissociation in the NaRb Dimer
PublikacjaWe study the dynamics of multiple coupled states under the influence of an arbitrary time-dependent external field to investigate the femtosecond laser-driven excitation and the spin-orbit mediated dissociation in the NaRb dimer. In this process, the dimer is excited from the ground triplet state 1^3Sigma+ to the 1^3Pi state using the femtosecond laser impulse and the spin-orbit coupling between the 1^3Pi and 2^1Sigma+ states results...
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Teoretyczne badanie struktury oscylacyjno-elektronowej cząsteczki NaRb z uwzględnieniem efektów relatywistycznych
PublikacjaZ wykorzystaniem kwantowo-chemicznych metod opartych na pseudopotencjałach opisujących oddziaływanie elektronów walencyjnych z atomowymi rdzeniami zostały policzone krzywe adiabatyczne energii potencjalnej. Na ich podstawie wyznaczono parametry spektroskopowe cząsteczki NaRb w ujęciu nierelatywistycznym i relatywistycznym. Policzyłem osiemnaście stanów nierelatywistycznych w symetrii Σ+, dziesięć stanów symetrii Π oraz cztery stany...
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Hula-hooping as an unusual cause of Koebner phenomenon in a psoriatic patient
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Off-label medications in the treatment of hospitalized children with atopic dermatitis
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Enoxaparin induced eruptive angiokeratomas
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Secukinumab for the Treatment of Psoriasis in Pediatrics: Patient Selection and Acceptability
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COVID-19 in Patients with Atopic Dermatitis Treated with Dupilumab: Three Cases and a Literature Review
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Epidemiological evaluation of paediatric psoriasis patients at the Dermatology Department
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Psoriasis and Atherosclerosis—Skin, Joints, and Cardiovascular Story of Two Plaques in Relation to the Treatment with Biologics
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Demodicosis as an opportunistic infection in a patient with Crohn’s disease treated with infliximab
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Seasonality of Psoriasis: From Genes to the Clinical Phenomena
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Trachyonychia successfully treated with low-dose acitretin in a paediatric patient
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Micronutrient deficiency with skin and systemic symptoms: a case report of acrodermatitis enteropathica
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Case report: Successful treatment with biologics in a pediatric patient with a severe inflammatory skin disease and novel CARD14 mutation
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Numerical modeling of quantum dynamical processes
PublikacjaIn this dissertation I present a high-precision (15, 18 or 33 decimal places) C++ implementation of quantum dynamics time propagation algorithms for both time-independent and time-dependent Hamiltonian with an inhomogeneous source term. Moreover I present an extension of both algorithms for time propagation to handle arbitrary number of coupled electronic levels. I have performed a careful validation of these implementations comparing...