Citation Impact
Citing Papers
A high-performance oxygen evolution catalyst in neutral-pH for sunlight-driven CO2 reduction
2019 StandoutNobel
Silicene: Compelling Experimental Evidence for Graphenelike Two-Dimensional Silicon
2012 Standout
Carbon dioxide capture from open air using covalent organic frameworks
2024 StandoutNatureNobel
Band alignment of rutile and anatase TiO2
2013 Standout
Atomic packing and short-to-medium-range order in metallic glasses
2006 StandoutNature
The Fano resonance in plasmonic nanostructures and metamaterials
2010 Standout
A multiple time step algorithm compatible with a large number of distance classes and an arbitrary distance dependence of the time step size for the fast evaluation of nonbonded interactions in molecular simulations
2006
A fast pairlist‐construction algorithm for molecular simulations under periodic boundary conditions
2004
Laser-induced porous graphene films from commercial polymers
2014 Standout
Physical Adsorption and Charge Transfer of Molecular Br2 on Graphene
2014 StandoutNobel
Two- and One-Dimensional Honeycomb Structures of Silicon and Germanium
2009 Standout
Heterocyclic Carbenes: Synthesis and Coordination Chemistry
2008 Standout
Structural and electronic properties of the liquid polyvalent elements: The group-IV elements Si, Ge, Sn, and Pb
1990
Inelastic X-Ray Scattering Study of Solid and Liquid Li and Na
1996 StandoutNobel
Generation and Reactions of Organic Radical Cations in Zeolites
2002
Transport in Proton Conductors for Fuel-Cell Applications: Simulations, Elementary Reactions, and Phenomenology
2004 Standout
Computer Simulation of Liquids
2017 Standout
Organic Photoredox Catalysis
2016 Standout
Identifying the Distribution of Al3+ in LiNi0.8Co0.15Al0.05O2
2016 StandoutNobel
Single-cycle infrared waveform control
2022 StandoutNobel
Epitaxial BiFeO 3 Multiferroic Thin Film Heterostructures
2003 StandoutScience
Screened hybrid density functionals applied to solids
2006 Standout
Quantum transport theory
1998
Theoretical Study of the Structural Evolution of a Na2FeMn(CN)6 Cathode upon Na Intercalation
2015 StandoutNobel
Radical anions of carbenes and carbene homologues. DFT study and preliminary experimental results
2001
First-principles calculations of the ferroelastic transition between rutile-type andCaCl 2 SiO 2
2008 Standout
Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set
1996 Standout
A fast and robust algorithm for Bader decomposition of charge density
2005 Standout
Melem (2,5,8-Triamino-tri-s-triazine), an Important Intermediate during Condensation of Melamine Rings to Graphitic Carbon Nitride: Synthesis, Structure Determination by X-ray Powder Diffractometry, Solid-State NMR, and Theoretical Studies
2003 Standout
Photochemical route for synthesizing atomically dispersed palladium catalysts
2016 StandoutScience
From ultrasoft pseudopotentials to the projector augmented-wave method
1999 Standout
Hybridized nearly-free-electron tight-binding-bond approach to interatomic forces in disordered transition-metal alloys. II. Modeling of metallic glasses
1992
Interfacial Effects in ε-LixVOPO4 and Evolution of the Electronic Structure
2015 StandoutNobel
Dynamics and instability of nonlinear Fano resonances in photonic crystals
2009
Helicenes: Synthesis and Applications
2011 Standout
Photochemistry of a Dumbbell-Shaped Multicomponent System Hosted Inside the Mesopores of Al/MCM-41 Aluminosilicate. Generation of Long-Lived Viologen Radicals
2003 StandoutNobel
Structural and electronic properties of molten GaAs
1989
Enzymatic construction of highly strained carbocycles
2018 StandoutScienceNobel
Electron Injection from Copper Diimine Sensitizers into TiO2: Structural Effects and Their Implications for Solar Energy Conversion Devices
2015 StandoutNobel
Instabilities and quasi-localized states in nonlinear Fano-like systems
2009
Ab initiomolecular-dynamics simulation of the liquid-metal–amorphous-semiconductor transition in germanium
1994 Standout
Three-Membered-Ring-Based Molecular Architectures
2006
Ab initio Hellmann-Feynman molecular dynamics for liquid metals
1993
Intramolecular nucleophilic capture of radical cations by tethered hydroxy functions
2006
Ab initiomolecular dynamics for liquid metals
1993 Standout
Electronic transport in two-dimensional graphene
2011 Standout
Dual Catalysis Strategies in Photochemical Synthesis
2016 Standout
Understanding Reactivity Patterns of Radical Cations
1997
Evolution of water structures in metal-organic frameworks for improved atmospheric water harvesting
2021 StandoutScienceNobel
Research on Advanced Materials for Li‐ion Batteries
2009 Standout
New Mechanism for Ferroelectricity in the Perovskite Ca2–xMnxTi2O6 Synthesized by Spark Plasma Sintering
2018 StandoutNobel
Strong-field nano-optics
2020
Ab initiomolecular dynamics for open-shell transition metals
1993 Standout
Ab initio molecular dynamics for liquid metals
1995 Standout
Superior Oxygen Electrocatalysis on RuSex Nanoparticles for Rechargeable Air Cathodes
2017 StandoutNobel
Structural modeling of transition-metal–metalloid glasses by use of tight-binding-bond forces
1993
Engineering Metal Organic Frameworks for Heterogeneous Catalysis
2010 Standout
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
1996 Standout
N-Heterocyclic Carbene Analogues with Low-Valent Group 13 and Group 14 Elements: Syntheses, Structures, and Reactivities of a New Generation of Multitalented Ligands
2010 Standout
Solar Synthesis: Prospects in Visible Light Photocatalysis
2014 StandoutScience
Liquid structure of transition metals: investigations using molecular dynamics and perturbation- and integral-equation techniques
1991
Increasing Solar Absorption for Photocatalysis with Black Hydrogenated Titanium Dioxide Nanocrystals
2011 StandoutScience
Improved tangent estimate in the nudged elastic band method for finding minimum energy paths and saddle points
2000 Standout
A climbing image nudged elastic band method for finding saddle points and minimum energy paths
2000 Standout
Works of Anton Arnold being referenced
Synthesis, Spectroscopic, and Structural Properties of Spirocyclopropanated Bicyclobutylidenes and Their Radical Cations
2001
An efficient method of bookkeeping next neighbours in molecular dynamics simulations
1990
Discrete transparent boundary conditions for the Schrödinger equation: fast calculation, approximation, and stability
2003
Applications of ENDOR spectroscopy to radical cations in freon matrixes. 9. The radical cation of benzvalene: an ESR and ENDOR study
1991
A molecular dynamics study of the structure of liquid germanium
1989
Diphenylcarbene cation: electronic and molecular structure
1993
On absorbing boundary conditions for quantum transport equations
1994
Applications of ENDOR spectroscopy to radical cations in Freon matrixes. 8. Structure of the paramagnetic species formed upon .gamma.-irradiation of hexamethyl (Dewar benzene) in a 1,1,2-trichlorotrifluoroethane matrix. An ESR and ENDOR study
1990
Applications of ENDOR spectroscopy to radical cations in Freon matrixes. Part 10. Structures and rearrangements of bicyclo[1.1.0]butane radical cations: an ESR and ENDOR study
1993
A Review of Transparent and Artificial Boundary Conditions Techniques for Linear and Nonlinear Schrödinger Equations
2007
Self-consistent relaxation-time models in quantum mechanics
1996