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-->{{
Topic|title=Density Mixing|show={{{1}}}
}}{{
Reference|key=broyden:mc:1965|show={{{1}}}|
Reference|key=broyden:mc:1965|show={{{1}}}|
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bib=C. G. Broyden, Math. Comput. '''19''', 577 (1965)|
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link=https://doi.org/10.1090/S0025-5718-1965-0198670-6
}}{{
}}{{
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Reference|key=pulay:cpl:1980|show={{{1}}}|
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}}{{
}}{{
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Reference|key=johnson:prb:1988|show={{{1}}}|
bib=D.D. Johnson, Phys. Rev. B '''38''', 12807 (1988)|
bib=D. D. Johnson, Phys. Rev. B '''38''', 12807 (1988)|
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link=https://doi.org/10.1103/PhysRevB.38.12807
}}{{
}}{{
Line 25: Line 20:
}}{{
}}{{
Reference|key=kresse:cms:1996|show={{{1}}}|
Reference|key=kresse:cms:1996|show={{{1}}}|
bib=G. Kresse, J. Furthmüller, Comp. Mater. Sci. '''6''', 15 (1996)|
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link=https://doi.org/10.1016/0927-0256(96)00008-0
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}}{{
Reference|key=kerker:prb:1981|show={{{1}}}|
bib=G.P. Kerker, Phys. Rev. B '''38''', 12087 (1981)|
link=https://doi.org/10.1103/PhysRevB.23.3082
}}{{
Topic|title=MetaGGAs|show={{{1}}}
}}{{
}}{{
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Reference|key=sun:prb:11|show={{{1}}}|
Line 39: Line 28:
}}{{
}}{{
Reference|key=sun:natm:16|show={{{1}}}|
Reference|key=sun:natm:16|show={{{1}}}|
bib=J. Sun et al., Nature Chemistry '''8''', 831–836 (2016).|
bib=J. Sun, R. C. Remsing, Y. Zhang, Z. Sun, A. Ruzsinszky, H. Peng, Z. Yang, A. Paul, U. Waghmare, X. Wu, M. L. Klein, and J. P. Perdew, Nat. Chem. '''8''', 831 (2016).|
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}}{{
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Reference|key=sun:jcp:12|show={{{1}}}|
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Reference|key=sun:jcp:13|show={{{1}}}|
Reference|key=sun:jcp:13|show={{{1}}}|
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Reference|key=tran:prl:09|show={{{1}}}|
Reference|key=tran:prl:09|show={{{1}}}|
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}}{{
Reference|key=teter:prb:1989|show={{{1}}}|
Reference|key=teter:prb:1989|show={{{1}}}|
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link=https://journals.aps.org/prb/abstract/10.1103/PhysRevB.40.12255
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}}{{
}}{{
Reference|key=bylander:prb:1990|show={{{1}}}|
Reference|key=bylander:prb:1990|show={{{1}}}|
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Reference|key=davidson:book:1983|show={{{1}}}|
bib=R. Davidson, Methods in Computational Molecular Physics edited by G.H.F. Diercksen and S. Wilson Vol. 113 NATO Advanced Study Institute, Series C (Plenum, New York, 1983), p. 95.|
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Reference|key=monkhorst:prb:1976|show={{{1}}}|
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Reference|key=bloechl:prb:1994|show={{{1}}}|
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Reference|key=allen:book:1991|show={{{1}}}|
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Reference|key=hoover:prl:1982|show={{{1}}}|
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Latest revision as of 12:46, 5 November 2024

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