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  • xTAPP

xTAPP

  • Openness:3 ★★★
  • Document quality:0 ☆☆☆

xTAPP is a first-principles plane-wave pseudo-potential code. It computes band structure and electronic states with high precision for a wide range of materials including metals, oxide surfaces, solid interfaces, and so forth. It has support tools and visualization of output and input, is available as a massively parallel computer using OpenMP, MPI, and GPGPU.

First-principles study of ionization and diffusion of metal atoms at metal/solid interfaces in electric fields

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