dft_inputs
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dft_inputs [2016/12/08 08:40] krejcio created |
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| - | Hartree potential that may serve as an input for the PPM can be produced by various DFT codes. Here we show examples, for couple of them: | ||
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| - | == Fireball == | ||
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| - | A fireball.in for creation of an fftpot.xsf file with Hartree potential with using a McWEDA functional should look like: | ||
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dft_inputs.txt ยท Last modified: 2017/01/26 14:58 (external edit)
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