Automag: An automatic workflow software for calculating the ground magnetic state of a given structure and estimating its critical temperature

We developed a Python package capable of finding the lowest-energy magnetic state of a given structure and to estimate its critical temperature from a Monte Carlo simulation of its effective Hamiltonian. In this paper, we introduce the code and present the results of tests performed on known materia...

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1. Verfasser: John Ballantyne
Format: Dataset
Sprache:eng
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