Citation Impact
Citing Papers
Direct Light‐Driven Modulation of Luminescence from Mn‐Doped ZnSe Quantum Dots
2008 StandoutNobel
Electronics based on two-dimensional materials
2014 Standout
Electron transfer process between Ce3 +donor and Yb3 +acceptor levels in the bandgap of Y3Al5O12(YAG)
2011
Energies, structures, and electronic properties of molecules in solution with the C‐PCM solvation model
2003 Standout
Narrow-band red-emitting Sr[LiAl3N4]:Eu2+ as a next-generation LED-phosphor material
2014 Standout
Semiempirical GGA‐type density functional constructed with a long‐range dispersion correction
2006 Standout
Tuning upconversion through energy migration in core–shell nanoparticles
2011 Standout
Enhanced Pressure Dependence of Magnetic Exchange inA 2 + [ V 2 ] O 4
2007 StandoutNobel
Orbital Localization, Charge Transfer, and Band Gaps in Semilocal Density-Functional Theory
2013
Effect of the damping function in dispersion corrected density functional theory
2011 Standout
Layer-dependent ferromagnetism in a van der Waals crystal down to the monolayer limit
2017 StandoutNature
Electronic Structures and Absorption Spectra of Linkage Isomers of Trithiocyanato (4,4‘,4‘ ‘-Tricarboxy-2,2‘:6,2‘ ‘-terpyridine) Ruthenium(II) Complexes: A DFT Study
2006
The use of UV/ozone-treated MoS2 nanosheets for extended air stability in organic photovoltaic cells
2014
Comparative assessment of a new nonempirical density functional: Molecules and hydrogen-bonded complexes
2003 Standout
Two-Dimensional, Ordered, Double Transition Metals Carbides (MXenes)
2015 Standout
First-principles calculations for point defects in solids
2014 Standout
The M06 suite of density functionals for main group thermochemistry, thermochemical kinetics, noncovalent interactions, excited states, and transition elements: two new functionals and systematic testing of four M06-class functionals and 12 other functionals
2007 Standout
Tuning Charge Transport Properties of Asymmetric Molecular Junctions
2017 StandoutNobel
Structure, Energetics, and Bonding of First Row Transition Metal Pentazolato Complexes: A DFT Study
2004
Coordinative Alignment in the Pores of MOFs for the Structural Determination of N-, S-, and P-Containing Organic Compounds Including Complex Chiral Molecules
2019 StandoutNobel
Dye-Sensitized Solar Cells
2010 Standout
Time-dependent density functional theory for molecules in liquid solutions
2001 Standout
Exchange functionals with improved long-range behavior and adiabatic connection methods without adjustable parameters: The mPW and mPW1PW models
1998 Standout
Screened hybrid density functionals applied to solids
2006 Standout
Lanthanide-Activated Phosphors Based on 4f-5d Optical Transitions: Theoretical and Experimental Aspects
2017 Standout
The physics of new luminescent materials
1987
Aromatic Gold and Silver ‘Rings': Hydrosilver(I) and Hydrogold(I) Analogues of Aromatic Hydrocarbons
2004
A new local density functional for main-group thermochemistry, transition metal bonding, thermochemical kinetics, and noncovalent interactions
2006 Standout
Challenges for Density Functional Theory
2011 Standout
Conceptual Density Functional Theory
2003 Standout
Asymptotic correction approach to improving approximate exchange–correlation potentials: Time-dependent density-functional theory calculations of molecular excitation spectra
2000
Electrophilicity Index
2006 Standout
Ce3+-Doped garnet phosphors: composition modification, luminescence properties and applications
2016 Standout
On the Energetics of ATP Hydrolysis in Solution
2009 StandoutNobel
Graphene-Like Two-Dimensional Materials
2013 Standout
Toward reliable density functional methods without adjustable parameters: The PBE0 model
1999 Standout
WIEN2k: An APW+lo program for calculating the properties of solids
2020 Standout
New developments in the polarizable continuum model for quantum mechanical and classical calculations on molecules in solution
2002 Standout
Thermoluminescence investigation of donor (Ce3 + 3 + 3 + 3 + 3 + 3 5 12
2012
A consistent and accurateab initioparametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu
2010 Standout
Luminescence of inorganic solids: From isolated centres to concentrated systems
1988
Electronic excitations: density-functional versus many-body Green’s-function approaches
2002 Standout
Density functional theory
1998
Progress in Ab Initio QM/MM Free-Energy Simulations of Electrostatic Energies in Proteins: Accelerated QM/MM Studies of pKa, Redox Reactions and Solvation Free Energies
2008 StandoutNobel
Absorption Spectrum and Solvatochromism of the [Ru(4,4‘-COOH-2,2‘-bpy)2(NCS)2] Molecular Dye by Time Dependent Density Functional Theory
2003
Excited-state absorption ofEu 2 +
1993
Analysis of Ce3+ luminescence quenching in solid solutions between Y3Al5O12 and Y3Ga5O12 by temperature dependence of photoconductivity measurement
2011
A comprehensive electron wavefunction analysis toolbox for chemists, Multiwfn
2024 Standout
Influence of the exchange screening parameter on the performance of screened hybrid functionals
2006 Standout
Electronic structure and optical properties of the lanthanide activated RE3(Al1−xGax)5O12 (RE=Gd, Y, Lu) garnet compounds
2012
Energy band gaps and lattice parameters evaluated with the Heyd-Scuseria-Ernzerhof screened hybrid functional
2005 Standout
Lanthanide-Based Luminescent Hybrid Materials
2009 Standout
Applications of 2D MXenes in energy conversion and storage systems
2018 Standout
Defect structure and electrical properties of molybdenum disulphide
2006
Density Functionals with Broad Applicability in Chemistry
2008 Standout
Luminescence quenching by photoionization and electron transport in a LaAlO3:Ce3+ crystal
2007
Recent Advances in Ultrathin Two-Dimensional Nanomaterials
2017 Standout
Nucleus-Independent Chemical Shifts (NICS) as an Aromaticity Criterion
2005 Standout
Magnetic properties of MoS2: Existence of ferromagnetism
2012
Magnetic hysteresis up to 80 kelvin in a dysprosium metallocene single-molecule magnet
2018 StandoutScience
Relating the energy of the[ Xe ] 5 d 1 Ce 3 +
2002
Chemical Structures and Performance of Perovskite Oxides
2001 Standout
Long persistent phosphors—from fundamentals to applications
2016 Standout
Thin chalcogenide films prepared by pulsed laser deposition – new amorphous materials applicable in optoelectronics and chemical sensors
2006
Insight into the Thermal Quenching Mechanism for Y3Al5O12:Ce3+through Thermoluminescence Excitation Spectroscopy
2015
Assessment of a long-range corrected hybrid functional
2006 Standout
A long-range-corrected time-dependent density functional theory
2004 Standout
Combined Experimental and DFT-TDDFT Computational Study of Photoelectrochemical Cell Ruthenium Sensitizers
2005 Standout
Universal Solvation Model Based on Solute Electron Density and on a Continuum Model of the Solvent Defined by the Bulk Dielectric Constant and Atomic Surface Tensions
2009 Standout
Surface Defects on Natural MoS2
2015
Chemical reactivity indexes in density functional theory
1999
Hybrid functionals based on a screened Coulomb potential
2003 Standout
Efficient hybrid density functional calculations in solids: Assessment of the Heyd–Scuseria–Ernzerhof screened Coulomb hybrid functional
2004 Standout
Lithium ion battery applications of molybdenum disulfide (MoS2) nanocomposites
2013
Works of F. Rogemond being referenced
Photoionization thresholds of rare-earth impurity ions. Eu2+:CaF2, Ce3+:YAG, and Sm2+:CaF2
1986
Absorption Spectra of Several Metal Complexes Revisited by the Time-Dependent Density-Functional Theory-Response Theory Formalism
2001
Study of plasma expansion induced by femtosecond pulsed laser ablation and deposition of diamond-like carbon films
2003
Fluorescence properties of Bi4Ge3O12(BGO) single crystals under laser excitation: Excited state dynamics and saturation effects
1985
Electrical properties of molybdenum disulfide MoS2. Experimental study and density functional calculation results
1997
Gradient-corrected exchange potential with the correct asymptotic behavior and the corresponding exchange-energy functional obtained from the virial theorem
1995