Reconciling ionization energies and band gaps of warm dense matter derived with ab initio simulations and average atom models

作者： G Massacrier , M Böhme , J Vorberger , F Soubiran , B Militzer

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摘要: The authors show how to modify simple Average Atom models so as recover at very high pressure or density the results of much heavier ab initio computer simulations.

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Reconciling ionization energies and band gaps of warm dense matter derived with ab initio simulations and average atom models

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Reconciling ionization energies and band gaps of warm dense matter derived with ab initio simulations and average atom models

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