MP2SS reduces finite-size errors in periodic MP2 to millihartree accuracy at coarser k-point meshes for gapped systems via auxiliary function subtraction.
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Meta-GGA functionals overestimate magnetic moments in bcc Cr and destabilize the incommensurate SDW relative to the commensurate AF state.
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Reduction of finite-size effects for second-order M{\o}ller-Plesset perturbation theory with singularity subtraction
MP2SS reduces finite-size errors in periodic MP2 to millihartree accuracy at coarser k-point meshes for gapped systems via auxiliary function subtraction.
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A first-principles study of bcc chromium beyond the generalized gradient approximation (GGA)
Meta-GGA functionals overestimate magnetic moments in bcc Cr and destabilize the incommensurate SDW relative to the commensurate AF state.