Publications

Radiation Resistant Camera System for Monitoring Deuterium Plasma Discharges in the Large Helical Device

Radiation resistant camera system was constructed for monitoring deuterium plasma discharges in the Large Helical Device (LHD). This system has contributed to safe operation dur...

Generalized Gradient Approximation Made Simple

Generalized gradient approximations (GGA's) for the exchange-correlation energy improve upon the local spin density (LSD) description of atoms, molecules, and solids. We present...

Using thematic analysis in psychology

Increasingly, adult Indigenous language learners are being identified as the “missing generation” of learners who hold great potential to contribute to the revival of Indigenous...

Molecular cloning : a laboratory manual

Molecular Cloning has served as the foundation of technical expertise in labs worldwide for 30 years. No other manual has been so popular, or so influential. Molecular Cloning, ...

Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

We present an efficient scheme for calculating the Kohn-Sham ground state of metallic systems using pseudopotentials and a plane-wave basis set. In the first part the applicatio...

Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density

A correlation-energy formula due to Colle and Salvetti [Theor. Chim. Acta 37, 329 (1975)], in which the correlation energy density is expressed in terms of the electron density ...

From ultrasoft pseudopotentials to the projector augmented-wave method

The formal relationship between ultrasoft (US) Vanderbilt-type pseudopotentials and Bl\"ochl's projector augmented wave (PAW) method is derived. It is shown that the total energ...

ImageNet classification with deep convolutional neural networks

We trained a large, deep convolutional neural network to classify the 1.2 million high-resolution images in the ImageNet LSVRC-2010 contest into the 1000 different classes. On t...

Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set

Density-functional exchange-energy approximation with correct asymptotic behavior

Current gradient-corrected density-functional approximations for the exchange energies of atomic and molecular systems fail to reproduce the correct 1/r asymptotic behavior of t...

<i>Ab initio</i>molecular dynamics for liquid metals

We present ab initio quantum-mechanical molecular-dynamics calculations based on the calculation of the electronic ground state and of the Hellmann-Feynman forces in the local-d...

Densely Connected Convolutional Networks

Recent work has shown that convolutional networks can be substantially deeper, more accurate, and efficient to train if they contain shorter connections between layers close to ...