Finite-size supercell correction schemes for charged defect calculations

Hannu-Pekka Komsa, Tapio T. Rantala, Alfredo Pasquarello

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268 Citations (Scopus)

Translated title of the contribution	Finite-size supercell correction schemes for charged defect calculations
Original language	English
Article number	045112
Pages (from-to)	1-16
Number of pages	16
Journal	Physical Review B
Volume	86
Issue number	4
DOIs	https://doi.org/10.1103/PhysRevB.86.045112
Publication status	Published - 2012
Publication type	A1 Journal article-refereed

Publication forum classification

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title = "Finite-size supercell correction schemes for charged defect calculations",

author = "Hannu-Pekka Komsa and Rantala, {Tapio T.} and Alfredo Pasquarello",

note = "Contribution: organisation=fys,FACT1=1<br/>Publisher name: American Physical Society, APS",

year = "2012",

doi = "10.1103/PhysRevB.86.045112",

language = "English",

volume = "86",

pages = "1--16",

journal = "Physical Review B",

issn = "1098-0121",

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}

TY - JOUR

T1 - Finite-size supercell correction schemes for charged defect calculations

AU - Komsa, Hannu-Pekka

AU - Rantala, Tapio T.

AU - Pasquarello, Alfredo

N1 - Contribution: organisation=fys,FACT1=1<br/>Publisher name: American Physical Society, APS

PY - 2012

Y1 - 2012

U2 - 10.1103/PhysRevB.86.045112

DO - 10.1103/PhysRevB.86.045112

M3 - Article

SN - 1098-0121

VL - 86

SP - 1

EP - 16

JO - Physical Review B

JF - Physical Review B

IS - 4

M1 - 045112

ER -