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Structural Stability of Iodide Perovskite: A Combined Cluster Expansion Method and First-Principles Study

https://doi.org/10.1021/acs.jpcc.7b07910
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Every reference with a DOI in the deposited reference list resolved to a known work in Crossref or DataCite at the dated check, and none carried a retraction, withdrawal, or removal notice.

2 without a DOI — not checked. A reference deposited without a DOI is never matched by title or guessed at; it stays outside the checked set, and this line discloses that.

The 32 checked references that resolve
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Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells
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Chemical Management for Colorful, Efficient, and Stable Inorganic–Organic Hybrid Nanostructured Solar Cells
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Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties
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Review of recent progress in chemical stability of perovskite solar cells
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First-Principles Hybrid Functional Study of the Organic–Inorganic Perovskites CH<sub>3</sub>NH<sub>3</sub>SnBr<sub>3</sub> and CH<sub>3</sub>NH<sub>3</sub>SnI<sub>3</sub>
resolves10.1038/srep04467
Relativistic GW calculations on CH3NH3PbI3 and CH3NH3SnI3 Perovskites for Solar Cell Applications
resolves10.1021/cm503122j
Influence of Defects and Synthesis Conditions on the Photovoltaic Performance of Perovskite Semiconductor CsSnI<sub>3</sub>
resolves10.1021/acs.jpcc.5b06436
Goldschmidt’s Rules and Strontium Replacement in Lead Halogen Perovskite Solar Cells: Theory and Preliminary Experiments on CH<sub>3</sub>NH<sub>3</sub>SrI<sub>3</sub>
resolves10.1039/C5NR04310G
Discovering lead-free perovskite solar materials with a split-anion approach
resolves10.1246/cl.150143
Alternative, Lead-free, Hybrid Organic–Inorganic Perovskites for Solar Applications: A DFT Analysis
resolves10.1021/acs.jpcc.6b04207
CH<sub>3</sub>NH<sub>3</sub>CaI<sub>3</sub> Perovskite: Synthesis, Characterization, and First-Principles Studies
resolves10.1021/nl504046x
Chalcogenide Perovskites for Photovoltaics
resolves10.1103/PhysRevB.89.155204
Relativistic quasiparticle self-consistent electronic structure of hybrid halide perovskite photovoltaic absorbers
resolves10.1021/jp508880y
Ab Initio Calculations of Band Gaps and Absolute Band Positions of Polymorphs of RbPbI<sub>3</sub> and CsPbI<sub>3</sub>: Implications for Main-Group Halide Perovskite Photovoltaics
resolves10.1021/acs.jpclett.6b00376
Lead-Free Halide Double Perovskites via Heterovalent Substitution of Noble Metals
resolves10.1021/jacs.7b02120
Cu–In Halide Perovskite Solar Absorbers
resolves10.1021/jacs.6b09645
Design of Lead-Free Inorganic Halide Perovskites for Solar Cells via Cation-Transmutation
resolves10.1021/acsenergylett.6b00471
Can Pb-Free Halide Double Perovskites Support High-Efficiency Solar Cells?
resolves10.1021/jz501896w
Anomalous Alloy Properties in Mixed Halide Perovskites
resolves10.1016/S0364-5916(02)80006-2
The alloy theoretic automated toolkit: A user guide
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Generalized cluster description of multicomponent systems
resolves10.1557/PROC-291-115
Phase Stability and Diagrams from First Principles
resolves10.1103/PhysRevB.53.6137
First-principles calculation of the pressure dependence of phase equilibria in the Al-Li system
resolves10.1103/PhysRevB.54.11169
Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set
resolves10.1016/0927-0256(96)00008-0
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
resolves10.1103/PhysRevLett.77.3865
Generalized Gradient Approximation Made Simple
resolves10.1103/PhysRevB.59.1758
From ultrasoft pseudopotentials to the projector augmented-wave method
resolves10.1088/0953-8984/21/8/084204
A grid-based Bader analysis algorithm without lattice bias
resolves10.1021/jp411112k
Formamidinium-Containing Metal-Halide: An Alternative Material for Near-IR Absorption Perovskite Solar Cells
resolves10.1039/c3ee43822h
Formamidinium lead trihalide: a broadly tunable perovskite for efficient planar heterojunction solar cells
resolves10.1021/acs.jpclett.6b00002
Cesium Lead Halide Perovskites with Improved Stability for Tandem Solar Cells
resolves10.1143/APEX.3.101201
Materials Design of Spinodal Nanodecomposition in CuIn<sub>1-<i>x</i></sub>Ga<sub><i>x</i></sub>Se<sub>2</sub>for High-Efficiency Solar Energy Conversion
The 2 references without a DOI — listed, not checked
no DOI — not checkedSeehttps://www.nrel.gov/pv/assets/images/efficiency-chart.pngfor NREL efficiency chart.
no DOI — not checkedSolid State Physics
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