Thermodynamic Stability and Defect Chemistry of Bismuth-Based Lead-Free Double Perovskites

Cs2AgBiX6 (X = Br, Cl): New Visible Light Absorbing, Lead-Free Halide Perovskite Semiconductors

(2016) Eric T. McClure et al.   CHEMISTRY OF MATERIALS

Photovoltaic Properties of Two-Dimensional (CH3NH3)2Pb(SCN)2I2 Perovskite: A Combined Experimental and Density Functional Theory Study

(2016) Zewen Xiao et al.   Journal of Physical Chemistry Letters

Band Gaps of the Lead-Free Halide Double Perovskites Cs2BiAgCl6 and Cs2BiAgBr6 from Theory and Experiment

(2016) Marina R. Filip et al.   Journal of Physical Chemistry Letters

Lead-Free Halide Double Perovskites via Heterovalent Substitution of Noble Metals

(2016) George Volonakis et al.   Journal of Physical Chemistry Letters

A Bismuth-Halide Double Perovskite with Long Carrier Recombination Lifetime for Photovoltaic Applications

(2016) Adam H. Slavney et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Theoretical insights into a potential lead-free hybrid perovskite: substituting Pb2+ with Ge2+

(2016) Ping-Ping Sun et al.   Nanoscale

Zero-dimensional (CH3NH3)3Bi2I9 perovskite for optoelectronic applications

(2016) Senol Öz et al.   SOLAR ENERGY MATERIALS AND SOLAR CELLS

Unipolar self-doping behavior in perovskite CH3NH3PbBr3

(2015) Tingting Shi et al.   APPLIED PHYSICS LETTERS

Route to n-type doping in SnS

(2015) Zewen Xiao et al.   APPLIED PHYSICS LETTERS

Ligand-Hole in [SnI6] Unit and Origin of Band Gap in Photovoltaic Perovskite Variant Cs2SnI6

(2015) Zewen Xiao et al.   BULLETIN OF THE CHEMICAL SOCIETY OF JAPAN

Ab Initio Molecular Dynamics Simulations of Methylammonium Lead Iodide Perovskite Degradation by Water

(2015) Edoardo Mosconi et al.   CHEMISTRY OF MATERIALS

Thin-Film Preparation and Characterization of Cs3Sb2I9: A Lead-Free Layered Perovskite Semiconductor

(2015) Bayrammurad Saparov et al.   CHEMISTRY OF MATERIALS

Crystal and Electronic Structures of Complex Bismuth Iodides A3Bi2I9 (A = K, Rb, Cs) Related to Perovskite: Aiding the Rational Design of Photovoltaics

(2015) Anna J. Lehner et al.   CHEMISTRY OF MATERIALS

(CH3NH3)2Pb(SCN)2I2: A More Stable Structural Motif for Hybrid Halide Photovoltaics?

(2015) Alex M. Ganose et al.   Journal of Physical Chemistry Letters

Density Functional Calculations of Native Defects in CH3NH3PbI3: Effects of Spin–Orbit Coupling and Self-Interaction Error

(2015) Mao-Hua Du   Journal of Physical Chemistry Letters

Intrinsic defects in a photovoltaic perovskite variant Cs2SnI6

(2015) Zewen Xiao et al.   PHYSICAL CHEMISTRY CHEMICAL PHYSICS

Intrinsic Thermal Instability of Methylammonium Lead Trihalide Perovskite

(2015) Bert Conings et al.   Advanced Energy Materials

Halide perovskite materials for solar cells: a theoretical review

(2015) Wan-Jian Yin et al.   Journal of Materials Chemistry A

Unusual defect physics in CH3NH3PbI3 perovskite solar cell absorber

(2014) Wan-Jian Yin et al.   APPLIED PHYSICS LETTERS

Lead-free organic–inorganic tin halide perovskites for photovoltaic applications

(2014) Nakita K. Noel et al.   Energy & Environmental Science

Strong Covalency-Induced Recombination Centers in Perovskite Solar Cell Material CH3NH3PbI3

(2014) Michael L. Agiorgousis et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Lead-free solid-state organic–inorganic halide perovskite solar cells

(2014) Feng Hao et al.   Nature Photonics

Relativistic quasiparticle self-consistent electronic structure of hybrid halide perovskite photovoltaic absorbers

(2014) Federico Brivio et al.   PHYSICAL REVIEW B

Relativistic GW calculations on CH3NH3PbI3 and CH3NH3SnI3 Perovskites for Solar Cell Applications

(2014) Paolo Umari et al.   Scientific Reports

Efficient carrier transport in halide perovskites: theoretical perspectives

(2014) M. H. Du   Journal of Materials Chemistry A

The origin of high efficiency in low-temperature solution-processable bilayer organometal halide hybrid solar cells

(2013) Shuangyong Sun et al.   Energy & Environmental Science

Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties

(2013) Constantinos C. Stoumpos et al.   INORGANIC CHEMISTRY

Importance of Spin–Orbit Coupling in Hybrid Organic/Inorganic Perovskites for Photovoltaic Applications

(2013) Jacky Even et al.   Journal of Physical Chemistry Letters

Long-Range Balanced Electron- and Hole-Transport Lengths in Organic-Inorganic CH3NH3PbI3

(2013) G. Xing et al.   SCIENCE

Cation ordering in perovskites

(2010) Graham King et al.   JOURNAL OF MATERIALS CHEMISTRY

Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells

(2009) Akihiro Kojima et al.   JOURNAL OF THE AMERICAN CHEMICAL SOCIETY

Assessment of correction methods for the band-gap problem and for finite-size effects in supercell defect calculations: Case studies for ZnO and GaAs

(2008) Stephan Lany et al.   PHYSICAL REVIEW B