In this chapter, we cover the usefulness and extent of performing computations using small animal models in cancer treatment with radiation therapy. Since mice are the most utilized animal models in cancer research, we ...

Monte Carlo (MC) simulation is widely recognized as an important technique to study the physics of particle interactions in nuclear medicine and radiation therapy. There are different codes dedicated to dosimetry applications ...

A recent experimental study has allowed synthesis of a new organic nonlinear optical material 3-(4- chlorophenyl)-1-(pyridin-3-yl)prop-2-en-1-one(CPP) with a high second harmonic generation efficiency. We apply density ...

The Hansen-Coppens multipolar formalism was used to investigate the experimental electron density (ED) distribution of phthalonitrile derivative from single crystal X-ray data. The crystal displays C–H⋅⋅⋅O and O–H⋅⋅⋅N ...

In this work we present a comparative structural study of the 4-methyl-N-[(5-nitrothiophen-2-ylmethylidene)] aniline molecule using X-ray diffraction and theoretical ab initio methods. The title compound is considered as ...

Dans le présent travail, nous avons étudié l’influence du nombre de Rayleigh thermique (103≤Rat≤105) et du nombre de Lewis (0,5≤Le≤5) sur la convection naturelle double-diffusive dans une cavité ...

In the present work the optimized molecular geometry and harmonic vibrational frequencies of chalcone derivative were calculated by DFT/B3LYP method with 6–31G (d,p) basis set. The vibrational assignments were performed ...