DFTB: the quantum mechanical SPM simulator |
The DFTB solver simulates STM, STS, AFM, and KPFM images of metals, semiconductors, and non-organic compounds.
Advantages of the DFTB are as follows: |
The DFTB performs simulations according to the quantum theory.
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The DFTB carries out calculations with the density functional based tight binding method.
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You can obtain simulation results more rapidly compared with the first-principles calculation.
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The DFTB can simulate AFM images of non-organic compounds put on surfaces of crystals of non-organic compounds and plates of metals.
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To prepare structural data of tips and sample materials,
please refer to the following web pages:
SetModel: software for constructing structural data of tips and sample materials
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