Graphic Algorithm of the Thermodynamic Functions

Theoretical study of the solvent effects on the thermodynamic functions of Alanine and Valine Amino Acids

Using Gaussian 03, software the thermodynamic functions such as Gibbs free energy, G, Enthalpy, H, and Entropy, S, of Alanine and Valine amino acids were theoretically studied at different solvents. First, the Density Functional Theory (B3LYP) level with 3-21G, 6-31G and 6-31+G basis sets were employed to optimization of isolated Alanine and Valine amino acids in the gas phase. Moreover, Vib...

the algorithm for solving the inverse numerical range problem

برد عددی ماتریس مربعی a را با w(a) نشان داده و به این صورت تعریف می کنیم w(a)={x8ax:x ?s1} ، که در آن s1 گوی واحد است. در سال 2009، راسل کاردن مساله برد عددی معکوس را به این صورت مطرح کرده است : برای نقطه z?w(a)، بردار x?s1 را به گونه ای می یابیم که z=x*ax، در این پایان نامه ، الگوریتمی برای حل مساله برد عددی معکوس ارانه می دهیم.

Airy Functions in the Thermodynamic Bethe Ansatz

Thermodynamic Bethe ansatz equations are coupled non-linear integral equations which appear frequently when solving integrable models. Those associated with models with N=2 supersymmetry can be related to differential equations, among them Painlevé III and the Toda hierarchy. In the simplest such case the massless limit of these non-linear integral equations can be solved in terms of the Airy f...

Thermodynamic Systems and State Functions

Cellular Genetic Algorithm on Graphic Processing Units

The availability of low cost powerful parallel graphic cards has estimulated a trend to implement diverse algorithms on Graphic Processing Units (GPUs). In this paper we describe the design of a parallel Cellular Genetic Algorithm (cGA) on a GPU and then evaluate its performance. Beyond the existing works on masterslave for fitness evaluation, we here implement a cGA exploiting data and instruc...