Recently, studies based on first principles for single H2O molecule adsorbed on freestanding graphene were performed by O. Leenaerts et al.[15].
In summary, based on first-principles calculations, we study the electronic structure and magnetic properties of 2D hexagonal silicene adsorbed with H and Br atoms.
Based on first-principles calculations, we study the structural, electronic, and magnetic properties of two-dimensional silicene saturated with hydrogen and bromine atoms.
We report the preliminary results of the ongoing study, based on first-year data from the first two trauma centers that implemented ECS.
Furthermore, the elastic moduli of the predicted intermetallics are studied based on first-principles calculations.
Ti-doping effects on the structure stability, Li+ diffusion, and working voltage of LiCo0.5Ni0.5O2 have been studied based on first-principle total energy calculations.
A systematic study based on first-principles calculations along with a quasi-harmonic approximation has been conducted to calculate the thermodynamic properties of the CexTh1−xO2 solid solution.
One study based on first-episode schizophrenia did not identify any positive effects of EPA on psychopathology, possibly due to the ceiling effect [ 26].
These studies are based on first-principles quantum transport calculations and non-equilibrium Green's function techniques.
The study was based on first-time embolectomies in the upper limb performed in Denmark from January 1 , 1990 to December 31 , 2002
The study was based on first-time embolectomies in the brachial, ulnar, or radial artery performed in Denmark from January 1 , 1990 to December 31 , 2002
