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Your search keyword '"Chien‐Pin Chou"' showing total 2 results
Start Over Author "Chien‐Pin Chou" Journal aip conference proceedings
2 results on '"Chien‐Pin Chou"'

1. Development of density-functional tight-binding repulsive potentials for bulk zirconia using particle swarm optimization algorithm

Author

Yoshifumi Nishimura, Chien Pin Chou, Aulia Sukma Hutama, and Stephan Irle

Subjects
Physics, Phase transition, Tetragonal crystal system, Classical mechanics, Tight binding, Chemical physics, Particle swarm optimization, Development (differential geometry), Cubic zirconia
Abstract

We report the preliminary results of the development of density-functional tight-binding (DFTB) repulsive potentials for the Zr – O element pair. The repulsive potentials were created using a computer code based on the particle swarm optimization. The potentials were tested on a set of systems for high temperature phases of bulk ZrO2, namely cubic and tetragonal. The potential sets were primarily developed for simulation of zirconia phase transitions at elevated temperatures.

Published
2017

2. Development of Density-Functional Tight-Binding Repulsive Potentials for Bulk Zirconia using Particle Swarm Optimization Algorithm.

Author

Hutama, Aulia S., Yoshifumi Nishimura, Chien-Pin Chou, and Irle, Stephan

Subjects
DENSITY functional theory, BINDING energy, ZIRCONIUM oxide, PARTICLE swarm optimization, HIGH temperatures
Abstract

We report the preliminary results of the development of density-functional tight-binding (DFTB) repulsive potentials for the Zr - O element pair. The repulsive potentials were created using a computer code based on the particle swarm optimization. The potentials were tested on a set of systems for high temperature phases of bulk ZrO2, namely cubic and tetragonal. The potential sets were primarily developed for simulation of zirconia phase transitions at elevated temperatures. [ABSTRACT FROM AUTHOR]

Published
2017
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