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SOKRAT-BN integrated code was used in the calculations in combination with KUPOL-BN and NOSTRADAMUS codes.
Using an accurate bootstrap current model and external current drive profiles from ray tracing calculations in combination with optimized pressure profiles, βN values above 7.0 have been obtained.
The thermal transport properties of graphene nanoribbons (GNRs) with pentagon heptagon defect (PHD) are studied by using first principles calculations in combination with non-equilibrium Green's function approach.
By means of first principles and tight-binding calculations in combination with analytical methods, we carried out detailed comparative studies of their structural, mechanical, thermal, and electronic properties.
The model consists of the statistical evaluation of numerous representative volume element (RVE) calculations in combination with a crystal plasticity (CP) constitutive model.
Ab initio periodic DFT calculations in combination with experimental FTIR of adsorption pyridine investigations have been used to study the acid base properties of vanadium doped zeolite materials.
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The photophysical behavior of the ligand and metal coordinated complex was characterized by steady state and time-resolved fluorescence, density functional theory calculation in combination with 1H NMR and mass spectroscopy results.
This work investigated the reaction mechanism of the alkylation of m-cresol with tert-butanol catalyzed by the SO3H-functionalized ionic liquid (IL) through quantum chemical calculation in combination with the experimental studies.
The calculation in combination with iterative NOE peak assignments was performed for 9 cycles, and a total of 200 structures were finally obtained.
Recent research has resulted in a first structural model of vimentin subunits with atomistic detail, which allows the first structural and mechanical property calculation in combination with experimental deformation tests [12], [13].
We have carefully analysed this paper, and found methodological inconsistencies and calculation errors that, in combination, render its conclusions not scientifically sound.
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