Related references
Note: Only part of the references are listed.Accurate prediction of emission energies with TD-DFT methods for platinum and iridium OLED materials
Glenn R. Morello
JOURNAL OF MOLECULAR MODELING (2017)
Stable Blue Phosphorescence Iridium(III) Cyclometalated Complexes Prompted by Intramolecular Hydrogen Bond in Ancillary Ligand
Seungjun Yi et al.
INORGANIC CHEMISTRY (2016)
Syntheses and characterizations of 5-nitro-2-(3′,5′di(trifluoromethyl)phenyl)pyridyl-containing iridium(III) complexes and the two-band white photoluminescence properties in solution
Jia-Xin Xu et al.
JOURNAL OF COORDINATION CHEMISTRY (2016)
Synthesis and characterization of red phosphorescent iridium(?) complexes based on electron-acceptor modulation of main ligand for high efficiency organic light-emitting diodes
Sang-Yong Park et al.
MOLECULAR CRYSTALS AND LIQUID CRYSTALS (2016)
Computational prediction for emission energy of iridium (III) complexes based on TDDFT calculations using exchange-correlation functionals containing various HF exchange percentages
Shengxian Xu et al.
JOURNAL OF MOLECULAR MODELING (2015)
Cyclometalated mono and dinuclear rhodium(III) and iridium(III) complexes with imidazolyl phenanthrolines: Synthesis and, photophysical and electrochemical characterization
Sourav Kanti Seth et al.
POLYHEDRON (2015)
Molecular models of site-isolated cobalt, rhodium, and iridium catalysts supported on zeolites: Ligand bond dissociation energies
Mingyang Chen et al.
COMPUTATIONAL AND THEORETICAL CHEMISTRY (2015)
Infrared Spectroscopic Characterization of Photoluminescent Polymer Nanocomposites
Kyle Gipson et al.
JOURNAL OF SPECTROSCOPY (2015)
Rhodium, Iridium, and Ruthenium Half-Sandwich Picolinamide Complexes as Anticancer Agents
Zahra Almodares et al.
INORGANIC CHEMISTRY (2014)
Synthesis, photophysical and electroluminescent properties of green organic light emitting devices based on novel iridium complexes containing benzimidazole ligands
Jayaraman Jayabharathi et al.
JOURNAL OF ORGANOMETALLIC CHEMISTRY (2014)
Principles of phosphorescent organic light emitting devices
Boris Minaev et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2014)
Structural and spectroscopic properties of Ir(III) complexes with phenylpyridine ligands: Absorption spectra without and with spin-orbit-coupling
Houari Brahim et al.
COMPUTATIONAL AND THEORETICAL CHEMISTRY (2014)
Bioactive iridium and rhodium complexes as therapeutic agents
Chung-Hang Leung et al.
COORDINATION CHEMISTRY REVIEWS (2013)
Synthesis, Cellular Uptake and Biological Activity Against Pathogenic Microorganisms and Cancer Cells of Rhodium and Iridium N-Heterocyclic Carbene Complexes Bearing Charged Substituents
Peter V. Simpson et al.
EUROPEAN JOURNAL OF INORGANIC CHEMISTRY (2013)
New complexes of cobalt(II) ions with pyridinecarboxylic acid N-oxides and 4,4′-byp
Zbigniew Hnatejko et al.
JOURNAL OF MOLECULAR STRUCTURE (2013)
The Kohn-Sham gap, the fundamental gap and the optical gap: the physical meaning of occupied and virtual Kohn-Sham orbital energies
E. J. Baerends et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2013)
Impact of a Picolinate Ancillary Ligand on Phosphorescence and Fluoride Sensing Properties of BMes2-Functionalized Platinum(II) Compounds
Soo-Byung Ko et al.
ORGANOMETALLICS (2013)
Structural and Spectral Characterization of a Chromium(III) Picolinate Complex: Introducing a New Redox Reaction
Mohammad Hakimi
JOURNAL OF THE KOREAN CHEMICAL SOCIETY-DAEHAN HWAHAK HOE JEE (2013)
Spin-orbit absorption spectroscopy of transition metal hydrides: A TD-DFT and MS-CASPT2 study of HM(CO)5 (M = Mn, Re)
Houari Brahim et al.
INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY (2012)
WinGX and ORTEP for Windows: an update
Louis J. Farrugia
JOURNAL OF APPLIED CRYSTALLOGRAPHY (2012)
Mechanism of intermolecular hydroacylation of vinylsilanes catalyzed by a rhodium(I) olefin complex: a DFT study
Qingxi Meng et al.
JOURNAL OF MOLECULAR MODELING (2012)
Tuning electronic structure and photophysical properties of [Ir(ppy)2(py)2]+ by substituents binding in pyridyl ligand: a computational study
Ting-Ting Zhang et al.
JOURNAL OF MOLECULAR MODELING (2012)
Comparison of Emission Characteristics with 4-, 5-, 6-Membered Iridium Complexes for OLEDs
Hye Rim Park et al.
MOLECULAR CRYSTALS AND LIQUID CRYSTALS (2012)
Avogadro: an advanced semantic chemical editor, visualization, and analysis platform
Marcus D. Hanwell et al.
JOURNAL OF CHEMINFORMATICS (2012)
Metal-Ligand Bonding Strength of Fluoro-Substituted Cyclometalated Iridium(III) Complexes from Raman and Infrared Spectra
Huei-Ru Tsai et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2011)
Modulation of iridium(III) phosphorescence via photochromic ligands: a density functional theory study
Xin Li et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Theoretical Study of the Cyclometalated Iridium(III) Complexes Used as Chromophores for Organic Light-Emitting Diodes
Boris Minaev et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2009)
The Blue Phosphorescent Iridium Complexes Containing New Triazole Ligands for OLEDs
So Youn Ahn et al.
MOLECULAR CRYSTALS AND LIQUID CRYSTALS (2009)
Synthesis and catalytic epoxidation potentiality of oxodiperoxo molybdenum(VI) complexes with pyridine-2-carboxaldoxime and pyridine-2-carboxylate: the crystal structure of PMePh3[MoO(O2)2(PyCO)]
Narottam Gharah et al.
TRANSITION METAL CHEMISTRY (2009)
cclib: A library for package-independent computational chemistry algorithms
Noel M. O'Boyle et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Assessment of density functionals for the investigation of iridium(III) complexes
Daobo Nie et al.
JOURNAL OF MOLECULAR STRUCTURE-THEOCHEM (2008)
Computational prediction of the regio- and diastereoselectivity in a rhodium-catalyzed hydroformylation/cyclization domino process
Giuliano Alagona et al.
JOURNAL OF MOLECULAR MODELING (2007)
Comparison of DFT methods for molecular orbital eigenvalue calculations
Gang Zhang et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Experimental (FT-IR, FT-Raman, 1H NMR) and theoretical study of magnesium, calcium, strontium, and barium picolinates
G Swiderski et al.
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY (2006)
Synthesis, structure and electrochemical properties of tris-picolinate complexes of rhodium and iridium
S Basu et al.
POLYHEDRON (2005)
Share Paper
