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Towards a New Exchange-Correlation Density Functional for more Accurate Band Gap Predictions
(2016-06-17)
Density-Functional Theory (DFT) offers a simplification to electronic structure problems by using the electron density instead of the wave-function. Unlike the wave-function which is a function of 3N variables (excluding ...
Optical Properties of Metal Clusters from First Principles Calculations
(2016-06-17)
Ground State structures of neutral Copper clusters Cu N =3−6 were generated and optimised within the framework of the Density Functional Theory (DFT) using Generalised Gradient Approximation (GGA) and ultrasoft pseudopotential. ...
Ultrafast X-rays Imaging For Medical Physics
(2016-06-17)
In this thesis we explored the production of highly coherent and energetic extreme ultra violet(XUV) radiation through the process of high harmonic generation(HHG). HHG is a process by which a ultrashort laser pulse interact ...
Analysis of Magneto Hemodynamics of Blood in a Stenosed Artery
(2016-06-17)
Human body responds to physical activities, external temperature, external magnetic field, and other factors by homeostatically adjusting its blood flow in order to deliver nutrients such as oxygen and glucose to every ...
Surface Modification of Polymeric Biomaterials for Cell/Tissue Integration
(2016-06-17)
This thesis presented the surface modification of polydimethyl siloxane (PDMS) to enhance surface wettability and surface roughness. Physical and chemical modifications were performed on cured surfaces of PDMS and PDMS-based ...