Citation Impact
Citing Papers
Dynamic personalities of proteins
2007 StandoutNature
Extreme Ultraviolet Fourier-Transform Spectroscopy with High Order Harmonics
2005 StandoutNobel
Inhibition of Simian Virus 40 replication by targeting the molecular chaperone function and ATPase activity of T antigen
2009
Electrostatic Origin of the Catalytic Power of Enzymes and the Role of Preorganized Active Sites
1998 StandoutNobel
Robust reconfigurable electromagnetic pathways within a photonic topological insulator
2016
Hybrid porous solids: past, present, future
2007 Standout
DNA-based self-assembly of chiral plasmonic nanostructures with tailored optical response
2012 StandoutNature
Iron-Catalyzed Reactions in Organic Synthesis
2004 Standout
Magnetic Spin Susceptibility of AsF 5
1978 StandoutNobel
Lifetime and predissociation yield of N214 b 1Πu(v=1)
2004 StandoutNobel
NANOCRYSTALLINE DIAMOND FILMS
1999
Singlet−Triplet Energy Gaps for Diradicals from Fractional-Spin Density-Functional Theory
2010
Energetics of the Catalytic Reaction of Ribonuclease A: A Computational Study of Alternative Mechanisms
1998 StandoutNobel
The equation-of-motion coupled-cluster method: Excitation energies of Be and CO
1989
Mie resonance-based dielectric metamaterials
2009
Solute Solvent Dynamics and Energetics in Enzyme Catalysis: The SN2 Reaction of Dehalogenase as a General Benchmark
2004 StandoutNobel
Copper Active Sites in Biology
2014 Standout
Organic Chemical Reactions in Supercritical Water
1999 Standout
A generalized restricted open-shell Fock operator
1987
Expanded Theory of H- and J-Molecular Aggregates: The Effects of Vibronic Coupling and Intermolecular Charge Transfer
2018 Standout
Investigation of Through-Bond Coupling Dependence on Spacer Structure
1996
Generation of optical beams with desirable orbital angular momenta by transformation media
2012
In situ mass spectrometry during diamond chemical vapor deposition using a low pressure flat flame
1997 StandoutNobel
Challenges for Density Functional Theory
2011 Standout
Apparent NAC Effect in Chorismate Mutase Reflects Electrostatic Transition State Stabilization
2003 StandoutNobel
Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis set
1996 Standout
General atomic and molecular electronic structure system
1993 Standout
Water Stability and Adsorption in Metal–Organic Frameworks
2014 Standout
Conceptual Density Functional Theory
2003 Standout
Density functional theory in surface chemistry and catalysis
2011 Standout
Mechanism of Molybdenum Nitrogenase
1996 Standout
Roles of Water for Chemical Reactions in High-Temperature Water
2002 Standout
Lewis acidity and basicity of cation-exchanged zeolites: QM/MM and density functional studies
2002
Combined Quantum Mechanical/Molecular Mechanical Methodologies Applied to Biomolecular Systems
1999
Charge-Transfer and Energy-Transfer Processes in π-Conjugated Oligomers and Polymers: A Molecular Picture
2004 Standout
Calculations of the structure and spectra of the putative transient peroxide intermediates of peroxidases
1997
Intermediate state representation approach to physical properties of electronically excited molecules
2004
How Important Are Quantum Mechanical Nuclear Motions in Enzyme Catalysis?
1996 StandoutNobel
The VUV photochemistry of radicals: C3H3and C2H5
2004
Advances in Non-Metallocene Olefin Polymerization Catalysis
2002 Standout
Self-Alignment of Plasmonic Gold Nanorods in Reconfigurable Anisotropic Fluids for Tunable Bulk Metamaterial Applications
2010
Geometry and singlet-triplet energy gap in methylene: a critical review of experimental and theoretical determinations
1985
Microscopic Imaging with Electrogenerated Chemiluminescence
2001
Dipole-allowed excited states of N2: Potential energy curves, vibrational analysis, and absorption intensities
2001
Microwave-Assisted Synthesis in Water as Solvent
2007 Standout
Cycloaddition Chemistry at Surfaces: Reaction of Alkenes with the Diamond(001)-2 × 1 Surface
2000
Quantum Mechanical/Molecular Mechanical Study on the Favorskii Rearrangement in Aqueous Media
2001
Quantum-Classical Molecular Dynamics Simulations of Proton Transfer Processes in Molecular Complexes and in Enzymes
1996
Quantum theory of molecular electronic structure
1980
Recent Developments in the Chemistry of Cubic Polyhedral Oligosilsesquioxanes
2010 Standout
Planar Photonics with Metasurfaces
2013 StandoutScience
Theoretical Study on Bis(imino)pyridyl−Fe(II) Olefin Poly- and Oligomerization Catalysts. Dominance of Different Spin States in Propagation and β-Hydride Transfer Pathways
2001
Myoglobin: The hydrogen atom of biology and a paradigm of complexity
2003
Organic Reactions in Aqueous Media with a Focus on Carbon−Carbon Bond Formations: A Decade Update
2005 Standout
Topological insulator laser: Experiments
2018 StandoutScience
Electrogenerated Chemiluminescence and Its Biorelated Applications
2008 Standout
A second-generation reactive empirical bond order (REBO) potential energy expression for hydrocarbons
2002 Standout
Density functional calculation of semiconductor surface phonons
1999
Electrogenerated Chemiluminescence Detection in Reversed-Phase Liquid Chromatography
2001
Phonons and related crystal properties from density-functional perturbation theory
2001 Standout
Advanced Carbon Electrode Materials for Molecular Electrochemistry
2008 Standout
Computer Simulation Studies of the Catalytic Mechanism of Human Aldose Reductase
2000 StandoutNobel
Origin of the Catalytic Power of Acetylcholinesterase: Computer Simulation Studies
1998 StandoutNobel
Self-Assembly of Silica Particles in a Nonionic Surfactant Hexagonal Mesophase
2009
Lanthanide-Containing Molecular and Supramolecular Polymetallic Functional Assemblies
2002
A Theoretical Model for the Active Site of Nitrogenase
1996
Strong Closed-Shell Interactions in Inorganic Chemistry
1997 Standout
Metamaterials: a new frontier of science and technology
2011
Role of Frontier Orbitals in Chemical Reactions
1982 StandoutScienceNobel
Difference frequency laser spectroscopy of the ν3 fundamental band of NH+2
1989 StandoutNobel
Chemistry and Biology Of Multicomponent Reactions
2012 Standout
Efficiency of ab-initio total energy calculations for metals and semiconductors using a plane-wave basis set
1996 Standout
Mechanistic Studies on Synthetic Fe−S-Based Clusters and Their Relevance to the Action of Nitrogenases
2005 StandoutNobel
Dimer reconstruction and electronic surface states on clean and hydrogenated diamond (100) surfaces
1996
Reaction mechanism of soot formation in flames
2002 Standout
Cyclic [2]Pseudorotaxane Tetramers Consisting of Two Rigid Rods Threaded through Two Bis-Macrocycles: Copper(I)-Templated Synthesis and X-ray Structure Studies
2008 StandoutNobel
Combining quantum mechanics and interatomic potential functions inab initio studies of extended systems
2000
Advances in Correlated Electronic Structure Methods for Solids, Surfaces, and Nanostructures
2007
Optically resonant dielectric nanostructures
2016 StandoutScience
Self-Assembly of Colloidal Nanocrystals: From Intricate Structures to Functional Materials
2016 Standout
Density Matrix Analysis and Simulation of Electronic Excitations in Conjugated and Aggregated Molecules
2002
The Electronic Structure of CuA: A Novel Mixed-Valence Dinuclear Copper Electron-Transfer Center
1996
Structure and Chemistry of Cytochrome P450
2005 Standout
Organophosphorus π-Conjugated Materials
2006 Standout
Single-Reference ab Initio Methods for the Calculation of Excited States of Large Molecules
2005 Standout
Works of Brian Weiner being referenced
Structural mechanism of RPA loading on DNA during activation of a simple pre‐replication complex
2006
Nanosphere dispersed liquid crystals for tunable negative-zero-positive index of refraction in the optical and terahertz regimes
2006
Near-infrared metamaterial films with reconfigurable transmissive/reflective properties
2008
Molecular dynamics with combined quantum and empirical potentials: C2H2 adsorption on Si(100)
1993
Reconstruction of (100) diamond surfaces using molecular dynamics with combined quantum and empirical forces
1994
Correlated electronic states of the lithium hydride molecule studied with the polarization propagator
1987
Polarization propagator calculations with an AGP reference state
1984
Chemistry of Acetylene on Diamond (100) Surfaces
1995
Elementary reaction mechanism of diamond growth from acetylene
1994
Elementary Reaction Mechanism for Growth of Diamond (100) Surfaces from Methyl Radicals
1994
1983
Theoretical study of reaction between phenylvinyleum ion and acetylene
1993
On the low-lying states and electronic spectroscopy of iron(II) porphine
1986
Structure and properties of C3H3+ cations
1989
Generalized Tamm–Dancoff approximation (GTDA) and random-phase approximation (GRPA) calculations on LiH, Be, and Li2
1987
Fukutome symmetry classification of the Kohn-Sham auxiliary one-matrix and its associated state or ensemble
1998
Molecular-dynamics study of oxygenated (100) diamond surfaces
1994
State energy functionals and variational equations in density functional theory
2000
The Role of Algebraic Formulations of Approximate Green's Functions for Systems With a Finite Number of Electrons
1980
An atomistic model for stepped diamond growth
1994 Nature
Electronic structure and spectra of various spin states of (porphinato)iron(III) chloride
1988
A theoretical analysis of a diamond (100)-(2×1) dimer bond
1995