Search Results - "Pask, J.E."
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1
Partition of unity finite element method for quantum mechanical materials calculations
Published in Extreme Mechanics Letters (01-02-2017)Get full text
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Calculation of positron observables using a finite element-based approach
Published in Applied surface science (01-08-1999)“…We report the development of a new method for calculating positron observables using a finite-element approach for the solution of the Schrodinger equation…”
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Journal Article Conference Proceeding -
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Efficient adaptive integration of functions with sharp gradients and cusps in n-dimensional parallelepipeds
Published in International journal for numerical methods in engineering (27-07-2012)“…SUMMARY In this paper, we study the efficient numerical integration of functions with sharp gradients and cusps. An adaptive integration algorithm is presented…”
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Finite-element methods in electronic-structure theory
Published in Computer physics communications (15-03-2001)“…We discuss the application of the finite-element (FE) method to ab initio solid-state electronic-structure calculations. In this method, the basis functions…”
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Theoretical Study of Electronic Properties of Zintl Phase KSi
Published in Chemistry of materials (01-12-1998)“…We have studied the electronic properties of Zintl phase KSi, by the ab initio density functional pseudopotential method. Our interest in this Zintl compound…”
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Effect of electron–electron interactions in a quantum dot with a tapered constriction
Published in Superlattices and microstructures (01-12-1997)“…We study the effect of electron–electron interactions between several electrons in a quantum dot with a tapered constriction by monitoring the behavior of the…”
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