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Add constant shift term to calc_v_Hxc func in EnergyAlt class #81

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merged 1 commit into from
Aug 26, 2021

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If the KS potential is shifted by a constant, this needs to be accounted for in the calculation of the v_Hxc integral term in the CalcEnergy class. See issue #79. This adds the correct term.

@timcallow timcallow linked an issue Aug 24, 2021 that may be closed by this pull request
@timcallow timcallow self-assigned this Aug 24, 2021
@timcallow timcallow merged commit ad7179c into develop Aug 26, 2021
@timcallow timcallow deleted the EnergyAlt_add_v_shift branch September 20, 2021 14:13
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EnergyAlt class misses the potential shift
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