Database-driven high-throughput study of coating materials for hybrid perovskites

Azimatu Seidu; Lauri Himanen; Jingrui Li; Patrick Rinke

doi:10.1088/1367-2630/ab34f0

Database-driven high-throughput study of coating materials for hybrid perovskites

Azimatu Seidu^*, Lauri Himanen, Jingrui Li, Patrick Rinke

^*Corresponding author for this work

Research output: Contribution to journal › Article › Scientific › peer-review

5 Citations (Scopus)

142 Downloads (Pure)

Abstract

We developed a high-throughput screening scheme to acquire candidate coating materials for hybrid perovskites. From more than 1.8 million entries of an inorganic compound database, we collected 93 binary and ternary materials with promising properties for protectively coating halide-perovskite photoabsorbers in perovskite solar cells. These candidates fulfill a series of criteria, including wide band gaps, abundant and non-toxic elements, water-insoluble, and small lattice mismatch with surface models of halide perovskites.

Original language	English
Article number	083018
Pages (from-to)	1-6
Number of pages	6
Journal	New Journal of Physics
Volume	21
DOIs	https://doi.org/10.1088/1367-2630/ab34f0
Publication status	Published - 9 Aug 2019
MoE publication type	A1 Journal article-refereed

Keywords

perovskites
solar cells
coating materials
interlayer materials
database
ELECTRON-TRANSPORT LAYER
SOLAR-CELLS
HALIDE PEROVSKITES
EFFICIENT
PERFORMANCE
INTERFACE
STABILITY
EMERGENCE
LENGTHS
DESIGN

Access to Document

10.1088/1367-2630/ab34f0Licence: CC BY

Seidu_2019_New_J._Phys._21_083018Final published version, 801 KBLicence: CC BY

OpenUrl availability

Full text

Science-IT
Mikko Hakala (Manager)
School of Science
Facility/equipment: Facility

Cite this

@article{9355581678604dcb86081192767191de,

title = "Database-driven high-throughput study of coating materials for hybrid perovskites",

abstract = "We developed a high-throughput screening scheme to acquire candidate coating materials for hybrid perovskites. From more than 1.8 million entries of an inorganic compound database, we collected 93 binary and ternary materials with promising properties for protectively coating halide-perovskite photoabsorbers in perovskite solar cells. These candidates fulfill a series of criteria, including wide band gaps, abundant and non-toxic elements, water-insoluble, and small lattice mismatch with surface models of halide perovskites.",

keywords = "perovskites, solar cells, coating materials, interlayer materials, database, ELECTRON-TRANSPORT LAYER, SOLAR-CELLS, HALIDE PEROVSKITES, EFFICIENT, PERFORMANCE, INTERFACE, STABILITY, EMERGENCE, LENGTHS, DESIGN",

author = "Azimatu Seidu and Lauri Himanen and Jingrui Li and Patrick Rinke",

note = "| openaire: EC/H2020/676580/EU//NoMaD ",

year = "2019",

month = aug,

day = "9",

doi = "10.1088/1367-2630/ab34f0",

language = "English",

volume = "21",

pages = "1--6",

journal = "New Journal of Physics",

issn = "1367-2630",

publisher = "IOP Publishing Ltd.",

}

TY - JOUR

T1 - Database-driven high-throughput study of coating materials for hybrid perovskites

AU - Seidu, Azimatu

AU - Himanen, Lauri

AU - Li, Jingrui

AU - Rinke, Patrick

N1 - | openaire: EC/H2020/676580/EU//NoMaD

PY - 2019/8/9

Y1 - 2019/8/9

N2 - We developed a high-throughput screening scheme to acquire candidate coating materials for hybrid perovskites. From more than 1.8 million entries of an inorganic compound database, we collected 93 binary and ternary materials with promising properties for protectively coating halide-perovskite photoabsorbers in perovskite solar cells. These candidates fulfill a series of criteria, including wide band gaps, abundant and non-toxic elements, water-insoluble, and small lattice mismatch with surface models of halide perovskites.

AB - We developed a high-throughput screening scheme to acquire candidate coating materials for hybrid perovskites. From more than 1.8 million entries of an inorganic compound database, we collected 93 binary and ternary materials with promising properties for protectively coating halide-perovskite photoabsorbers in perovskite solar cells. These candidates fulfill a series of criteria, including wide band gaps, abundant and non-toxic elements, water-insoluble, and small lattice mismatch with surface models of halide perovskites.

KW - perovskites

KW - solar cells

KW - coating materials

KW - interlayer materials

KW - database

KW - ELECTRON-TRANSPORT LAYER

KW - SOLAR-CELLS

KW - HALIDE PEROVSKITES

KW - EFFICIENT

KW - PERFORMANCE

KW - INTERFACE

KW - STABILITY

KW - EMERGENCE

KW - LENGTHS

KW - DESIGN

U2 - 10.1088/1367-2630/ab34f0

DO - 10.1088/1367-2630/ab34f0

M3 - Article

VL - 21

SP - 1

EP - 6

JO - New Journal of Physics

JF - New Journal of Physics

SN - 1367-2630

M1 - 083018

ER -

Database-driven high-throughput study of coating materials for hybrid perovskites

Abstract

Keywords

Access to Document

OpenUrl availability

Fingerprint

Equipment

Science-IT

Cite this