相关参考文献
注意:仅列出部分参考文献,下载原文获取全部文献信息。Alternative, Lead-free, Hybrid Organic-Inorganic Perovskites for Solar Applications: A DFT Analysis
Giacomo Giorgi et al.
CHEMISTRY LETTERS (2015)
Prediction of Stable Nitride Perovskites
Rafael Sarmiento-Perez et al.
CHEMISTRY OF MATERIALS (2015)
Ferroelectric Polarization of CH3NH3PbI3: A Detailed Study Based on Density Functional Theory and Symmetry Mode Analysis
Alessandro Stroppa et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2015)
Chalcogenide Perovskites for Photovoltaics
Yi-Yang Sun et al.
NANO LETTERS (2015)
Metal-halide perovskites for photovoltaic and light-emitting devices
Samuel D. Stranks et al.
NATURE NANOTECHNOLOGY (2015)
Tin perovskite/fullerene planar layer photovoltaics: improving the efficiency and stability of lead-free devices
Kenneth P. Marshall et al.
JOURNAL OF MATERIALS CHEMISTRY A (2015)
Halide perovskite materials for solar cells: a theoretical review
Wan-Jian Yin et al.
JOURNAL OF MATERIALS CHEMISTRY A (2015)
Temperature dependence of hole conductor free formamidinium lead iodide perovskite based solar cells
Sigalit Aharon et al.
JOURNAL OF MATERIALS CHEMISTRY A (2015)
Review of recent progress in chemical stability of perovskite solar cells
Guangda Niu et al.
JOURNAL OF MATERIALS CHEMISTRY A (2015)
Near-band-edge optical responses of solution-processed organic-inorganic hybrid perovskite CH3NH3PbI3 on mesoporous TiO2 electrodes
Yasuhiro Yamada et al.
APPLIED PHYSICS EXPRESS (2014)
Strain effects on the band gap and optical properties of perovskite SrSnO3 and BaSnO3
David J. Singh et al.
APPLIED PHYSICS LETTERS (2014)
Formamidinium lead trihalide: a broadly tunable perovskite for efficient planar heterojunction solar cells
Giles E. Eperon et al.
ENERGY & ENVIRONMENTAL SCIENCE (2014)
The structural diversity of ABS3 compounds with d0 electronic configuration for the B-cation
John A. Brehm et al.
JOURNAL OF CHEMICAL PHYSICS (2014)
Atomistic Origins of High-Performance in Hybrid Halide Perovskite Solar Cells
Jarvist M. Frost et al.
NANO LETTERS (2014)
Relativistic quasiparticle self-consistent electronic structure of hybrid halide perovskite photovoltaic absorbers
Federico Brivio et al.
PHYSICAL REVIEW B (2014)
Rational design of all organic polymer dielectrics
Vinit Sharma et al.
NATURE COMMUNICATIONS (2014)
Steric engineering of metal-halide perovskites with tunable optical band gaps
Marina R. Filip et al.
NATURE COMMUNICATIONS (2014)
Structural transition and unusually strong antiferromagnetic superexchange coupling in perovskite KAgF3
Dominik Kurzydlowski et al.
CHEMICAL COMMUNICATIONS (2013)
Semiconducting Tin and Lead Iodide Perovskites with Organic Cations: Phase Transitions, High Mobilities, and Near-Infrared Photoluminescent Properties
Constantinos C. Stoumpos et al.
INORGANIC CHEMISTRY (2013)
Materials Design and Discovery with High-Throughput Density Functional Theory: The Open Quantum Materials Database (OQMD)
James E. Saal et al.
JOM (2013)
First-principles structural design of superhard materials
Xinxin Zhang et al.
JOURNAL OF CHEMICAL PHYSICS (2013)
Small Photocarrier Effective Masses Featuring Ambipolar Transport in Methylammonium Lead Iodide Perovskite: A Density Functional Analysis
Giacomo Giorgi et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)
Importance of Spin-Orbit Coupling in Hybrid Organic/Inorganic Perovskites for Photovoltaic Applications
Jacky Even et al.
JOURNAL OF PHYSICAL CHEMISTRY LETTERS (2013)
Ab initio screening methodology applied to the search for new permanent magnetic materials
Nedko Drebov et al.
NEW JOURNAL OF PHYSICS (2013)
Electronic band structure, phonons, and exciton binding energies of halide perovskites CsSnCl3, CsSnBr3, and CsSnI3
Ling-yi Huang et al.
PHYSICAL REVIEW B (2013)
Identification and design principles of low hole effective mass p-type transparent conducting oxides
Geoffroy Hautier et al.
NATURE COMMUNICATIONS (2013)
Synthesis and crystal chemistry of the hybrid perovskite (CH3NH3) PbI3 for solid-state sensitised solar cell applications
Tom Baikie et al.
JOURNAL OF MATERIALS CHEMISTRY A (2013)
Commentary: The Materials Project: A materials genome approach to accelerating materials innovation
Anubhav Jain et al.
APL MATERIALS (2013)
New cubic perovskites for one- and two-photon water splitting using the computational materials repository
Ivano E. Castelli et al.
ENERGY & ENVIRONMENTAL SCIENCE (2012)
Computational screening of perovskite metal oxides for optimal solar light capture
Ivano E. Castelli et al.
ENERGY & ENVIRONMENTAL SCIENCE (2012)
All-solid-state dye-sensitized solar cells with high efficiency
In Chung et al.
NATURE (2012)
Identification of Potential Photovoltaic Absorbers Based on First-Principles Spectroscopic Screening of Materials
Liping Yu et al.
PHYSICAL REVIEW LETTERS (2012)
Lead Iodide Perovskite Sensitized All-Solid-State Submicron Thin Film Mesoscopic Solar Cell with Efficiency Exceeding 9%
Hui-Seon Kim et al.
SCIENTIFIC REPORTS (2012)
VESTA 3 for three-dimensional visualization of crystal, volumetric and morphology data
Koichi Momma et al.
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2011)
Screening for high-performance piezoelectrics using high-throughput density functional theory
Rickard Armiento et al.
PHYSICAL REVIEW B (2011)
Opportunities and challenges for first-principles materials design and applications to Li battery materials
Gerbrand Ceder
MRS BULLETIN (2010)
KAgF3, K2AgF4 and K3Ag2F7: important steps towards a layered antiferromagnetic fluoroargentate(II)
Zoran Mazej et al.
CRYSTENGCOMM (2009)
Organometal Halide Perovskites as Visible-Light Sensitizers for Photovoltaic Cells
Akihiro Kojima et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Ab initio materials design for transparent-conducting-oxide-based new-functional materials
H. Katayama-Yoshida et al.
APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING (2007)
Prediction of polar ordered oxynitride perovskites
Razvan Caracas et al.
APPLIED PHYSICS LETTERS (2007)
Structural, photocatalytic, and photophysical properties of perovskite MSnO3 (M = Ca, Sr, and Ba) photocatalysts
Weifeng Zhang et al.
JOURNAL OF MATERIALS RESEARCH (2007)
BoltzTraP. A code for calculating band-structure dependent quantities
Georg K. H. Madsen et al.
COMPUTER PHYSICS COMMUNICATIONS (2006)
Linear optical properties in the projector-augmented wave methodology
M Gajdos et al.
PHYSICAL REVIEW B (2006)
Hybrid functionals based on a screened Coulomb potential
J Heyd et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Epitaxial BiFeO3 multiferroic thin film heterostructures
J Wang et al.
SCIENCE (2003)
Refinement of the crystal structure of lead titanate with different degrees of imperfection of cationic and anionic sublattices by the Rietveld method
AI Akimov et al.
CRYSTALLOGRAPHY REPORTS (2003)