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List of works by Alistair P. Rendell

Automatically generated Coulomb fitting basis sets: design and accuracy for systems containing H to Kr.

scientific article published in August 2007

Comparison of linear-scaling semiempirical methods and combined quantum mechanical/molecular mechanical methods for enzymic reactions. II. An energy decomposition analysis.

scientific article

Energy-Efficient Computational Chemistry: Comparison of x86 and ARM Systems

scientific article

First principles study of gallium‐cleaning for hydrogen‐contaminated α‐Al2O3(0001) surfaces ⬇️

scientific article published on February 5, 2013

Modeling nonlinear ultrasound propagation in heterogeneous media with power law absorption using a k-space pseudospectral method.

scientific article published in June 2012

Quantum Chemical Calculations Using Accelerators: Migrating Matrix Operations to the NVIDIA Kepler GPU and the Intel Xeon Phi.

scientific article published on March 2014

Resolutions of the Coulomb Operator: VII. Evaluation of Long-Range Coulomb and Exchange Matrices.

scientific article published on 16 January 2013

Resolutions of the Coulomb operator: VIII. Parallel implementation using the modern programming language X10.

scientific article published on 11 September 2014

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