Citation Impact
Citing Papers
Examining the case for the effect of barrier compression on tunneling, vibrationally enhanced catalysis, catalytic entropy and related issues
2010 StandoutNobel
Infrared and Raman Measurements of Halogen Bonding in Cryogenic Solutions
2014
Absolute Rate Calculations: Atom and Proton Transfers in Hydrogen‐Bonded Systems
2005
Theoretical Chemistry of Gold
2004 Standout
What is the Nature of the First‐Formed Intermediates in the Electrophilic Halogenation of Alkenes, Alkynes, and Allenes?
2003
Extreme Ultraviolet Fourier-Transform Spectroscopy with High Order Harmonics
2005 StandoutNobel
CHARMM general force field: A force field for drug‐like molecules compatible with the CHARMM all‐atom additive biological force fields
2009 Standout
On the Nature of Blueshifting Hydrogen Bonds
2014
Alcohols, ethers, carbohydrates, and related compounds. I. The MM4 force field for simple compounds
2003
The effect of cooperative hydrogen bonding on the OH stretching-band shift for water clusters studied by matrix-isolation infrared spectroscopy and density functional theory
2005
Interactions with Aromatic Rings in Chemical and Biological Recognition
2003 Standout
C–H⋯O and other weak hydrogen bonds. From crystal engineering to virtual screening
2005
Resonance Raman and surface- and tip-enhanced Raman spectroscopy methods to study solid catalysts and heterogeneous catalytic reactions
2010
Infrared spectroscopy of proteins
2007 Standout
The Hydrogen Bond in the Solid State
2002 Standout
Surface‐Enhanced Raman Spectroscopy: Concepts and Chemical Applications
2014 Standout
IR Spectroscopic Study on the Hydration and the Phase Transition of Poly(vinyl methyl ether) in Water
2001
A Combined Infrared Photodissociation and Theoretical Study of the Interaction of Ethanol with Small Gold Clusters
2001
The in-equivalence of the HCl molecules in (HCl)2: An SCF a b i n i t i o calculation
1982
Effect of Ions on the Structure of Water: Structure Making and Breaking
2009 Standout
Characterization of the bifurcated structure of the water dimer
1991 StandoutNobel
Transition structures for the interchange of hydrogen atoms within the water dimer
1990 StandoutNobel
The Structure of Microsolvated Benzene Derivatives and the Role of Aromatic Substituents
2000
Predicting Hydrogen-Bond Strengths from Acid−Base Molecular Properties. The pKa Slide Rule: Toward the Solution of a Long-Lasting Problem
2008
Infrared predissociation spectra of water dimer in a supersonic molecular beam
1984
Structures and vibrational spectra of water clusters in the self-consistent-field approximation
1992
IR spectroscopy and photosensitivity of the H2OLi complex trapped in a krypton matrix
1985
Stimuli-reponsive polymers and their bioconjugates
2004 Standout
Infrared absorption spectroscopy of CO2–HX complexes using the CO2 asymmetric stretch chromophore: CO2HF(DF) and CO2HCl(DCl) linear and CO2HBr bent equilibrium geometries
1990
Blue-Shifting Hydrogen Bonds
2002
Ammonia dimer: A surprising structure
1985
Molecular Mechanics (MM3) calculations on sulfides
1991
Noncovalent Interactions: A Challenge for Experiment and Theory
1999 Standout
Implicit Solvation Models: Equilibria, Structure, Spectra, and Dynamics
1999 Standout
Matrix-isolation IR studies on the basic interaction sites in esters and thiolesters towards proton donors
1988
Blue-Shifting Hydrogen Bonds
2000 Standout
Femtosecond pH jump: dynamics of acid—base reactions in solvent cages
1994 StandoutNobel
Study of interface composition and quality in AlSb/InAs/AlSb quantum wells by Raman scattering from interface modes
1992 StandoutNobel
Electrophilicity Index
2006 Standout
A five-site model for liquid water and the reproduction of the density anomaly by rigid, nonpolarizable potential functions
2000 Standout
Polymorph-Dependent Molecular Valence Tautomerism Synchronized with Crystal-Melt Phase Transitions
2009 StandoutNobel
Probing zeolites by vibrational spectroscopies
2015
GaAs, AlAs, and AlxGa1−xAs: Material parameters for use in research and device applications
1985 Standout
Ab initio vibrational spectrum of HCN monomer, dimer and trimer
1989
Halogen Bonding Based Recognition Processes: A World Parallel to Hydrogen Bonding
2005 Standout
Infrared Cavity Ringdown Spectroscopy of the Water Cluster Bending Vibrations
1999
The infrared predissociation spectra of water clusters
1985
Single Crystals Heterogeneity Impacts the Intrinsic and Extrinsic Properties of Metal–Organic Frameworks
2021 StandoutNobel
Theoretical study of the silicon–oxygen hydrides SiOHn (n=0–4) and SiOH+n (n=0–5): Dissociation energies, ionization energies, enthalpies of formation, and proton affinities
1993 StandoutNobel
Infrared Spectrum of 4-Methoxypicolinic Acid N-Oxide: Computation of Asymmetric O−H Stretching Band
2007
The VUV photochemistry of radicals: C3H3and C2H5
2004
Molecular Vibrations of Solvated Uracil. Ab Initio Reaction Field Calculations and Experiment
1997
Infrared spectra of carbon monoxide trapped in solid argon. Double-doping experiments with H2O, NH3 and N2
1972
Evidence for Intramolecular N−H···O Resonance-Assisted Hydrogen Bonding in β-Enaminones and Related Heterodienes. A Combined Crystal-Structural, IR and NMR Spectroscopic, and Quantum-Mechanical Investigation
2000 Standout
On the tautomerism of maleimide and phthalimide derivatives
1994
A Cluster Study of Anionic Hydration: Spectroscopic Characterization of the I-·Wn, 1 ≤ n ≤ 3, Supramolecular Complexes at the Primary Steps of Solvation
1999
Natural bond orbital analysis of near-Hartree–Fock water dimer
1983 Standout
Matrix-Isolation Infrared Spectroscopy of Hydrogen-Bonded Complexes of Triethyl Phosphate with H2O, D2O, and Methanol
1994
The nature of the hydrated excess proton in water
1999 StandoutNature
Femtosecond real-time probing of reactions. VIII. The bimolecular reaction Br+I2
1992 StandoutNobel
FTIR spectra of matrix isolated complexes between sulfur compounds
1991
Transient spectral hole burning and hydrogen-bond breaking determined in different solutions of ethanol in deuterated ethanol
1999
Investigation of the Early Steps in Electrophilic Bromination through the Study of the Reaction with Sterically Encumbered Olefins
1997
Adsorption of Dimethyl Methylphosphonate on Self-Assembled Alkanethiolate Monolayers
1998
Ground and n–π* excited state structures of the hydrogen bonded complexes pyrazine⋅H2O and pyrazine⋅ (H2O)2
1979 StandoutNobel
On the Physical Origin of Blue-Shifted Hydrogen Bonds
2002
Infrared Spectroscopy of Size-Selected Water and Methanol Clusters
2000
Red-, Blue-, or No-Shift in Hydrogen Bonds: A Unified Explanation
2007
INS and IR and NMR Spectroscopic Study of C1−C4Alcohols Adsorbed on Alkali Metal-Exchanged Zeolite X
2004
Variation with the intermolecular distance of properties dependent on the electron density in hydrogen bond dimers
2001
An empirical correlation between stretching vibration redshift and hydrogen bond length
2000
Infrared matrix isolation studies of hydrogen bonds involving C-H bonds: CF3H, (CF2H)2O and CF3OCF2H with selected bases
1991
Optical studies of the vibrational properties of disordered solids
1975
The exciton model in molecular spectroscopy
1965 Standout
The Halogen Bond
2016 Standout
An evaluation of water cluster geometries derived from semi-empirical AM1 calculations
1988
Hydrogen Bridges in Crystal Engineering: Interactions without Borders
2002 Standout
Influence of the interface composition of InAs/AlSb superlattices on their optical and structural properties
1995 StandoutNobel
Sub-Doppler resolution infrared spectroscopy of water dimer
1988
First-principles simulation: ideas, illustrations and the CASTEP code
2002 Standout
Reliable theoretical treatment of molecular clusters: Counterpoise-corrected potential energy surface and anharmonic vibrational frequencies of the water dimer
1999
Structure and dynamics of the symmetric hydrogen bond in potassium hydrogen maleate: a neutron scattering study
1999
Structure and spectroscopy of (HCN)n clusters: Cooperative and electronic delocalization effects in C–H⋅⋅⋅N hydrogen bonding
1995
Ab initio studies of cyclic water clusters (H2O)n, n=1–6. I. Optimal structures and vibrational spectra
1993
Intermediacy of hydroxymethylene (HCOH) in the low temperature matrix photochemistry of formaldehyde
1978
Conformational Flexibility of Phosphate, Phosphonate, and Phosphorothioate Methyl Esters in Aqueous Solution
1998 StandoutNobel
Impact of Molecular Clustering inside Nanopores on Desorption Processes
2013 StandoutNobel
Applications of Fluorine in Medicinal Chemistry
2015 Standout
Relative propensity of methanol and silanol towards hydrogen bond formation
1992
CF2H, a Hydrogen Bond Donor
2017 Standout
From weak to strong interactions: A comprehensive analysis of the topological and energetic properties of the electron density distribution involving X–H⋯F–Y systems
2002 Standout
IRC approach to chemical dynamics: toward mode-selective chemical reactions
1981 StandoutNobel
Theoretical investigation of Li and Be atom complexes with H2O
1985 StandoutNobel
An ab initio SCF calculation of the dipole-moment derivatives and infrared-absorption intensities of the water-dimer molecule
1983
Size-Specific Infrared Spectra of Benzene-(H 2 O) n Clusters ( n = 1 through 7): Evidence for Noncyclic (H 2 O) n Structures
1994 Science
Infrared spectra of matrix-isolated monomeric and dimeric hydrogen sulfide in solid O2
1986
Ab initio studies of the water dimer using large basis sets: The structure and thermodynamic energies
1992
From silicon to RNA: The coming of age of ab initio molecular dynamics
1997
Combined Covalent-Electrostatic Model of Hydrogen Bonding Improves Structure Prediction with Rosetta
2015 StandoutNobel
Hydrogen bonds between hydrogen halides and unsaturated hydrocarbons
1982 StandoutNobel
Determination of the structural parameters for the van der Waals complexes between N2 and ClF molecules
1992 StandoutNobel
Supercritical water: relationships of certain measured properties to the extent of hydrogen bonding obtained from a semi-empirical model
2000
Hydrogen bonds between first-row hydrides and acetylene
1983 StandoutNobel
Quality of AlAs-like and InSb-like interfaces in InAs/AlSb superlattices: An optical study
1993 StandoutNobel
Experimental Evidence for Intramolecular Blue-Shifting C−H···O Hydrogen Bonding by Matrix-Isolation Infrared Spectroscopy
2003 StandoutNobel
The intermolecular vibrations of the bifurcated water dimer: An Ab initio study
1991
Structures, harmonic frequencies and infrared intensities of the dimers of H2O and H2S
1986
Ab initio molecular dynamics simulation of liquid water: Comparison of three gradient-corrected density functionals
1996
COMPASS: An ab Initio Force-Field Optimized for Condensed-Phase ApplicationsOverview with Details on Alkane and Benzene Compounds
1998 Standout
Localized vibrational modes in GaN:O tracing the formation of oxygenDX
2000 StandoutNobel
Works of A.J. Barnes being referenced
Nucleic acid bases studied by matrix isolation vibrational spectroscopy: Uracil and deuterated uracils
1984
Infra-red cryogenic studies. Part 11.—Hydrogen iodide and HI complexes
1973
Blue-shifting hydrogen bonds—are they improper or proper?
2004
Jet spectroscopy and molecular dynamics
1996
Hydrogen sulphide – halogen complexes studied by matrix isolation vibrational spectroscopy
1985
Study of intermolecular interactions by matrix isolation vibrational spectroscopy
1980
Anharmonic interactions and infrared bandshape of the hydrogen bond vibration of potassium hydrogen (deuterium) maleate crystals
2007
Infra-red cryogenic studies. Part 9.—Methanethiol and ethanethiol in matrices
1972
Molecular complexes of hydrogen halides with ethers and sulphides studied by matrix isolation vibrational spectroscopy
1986
The vibrational spectrum of the dimethyl ether-water complex
1983
Studies of intermolecular interactions by matrix isolation vibrational spectroscopy
1980
Reversal of the usual spectral shift of haloforms in some hydrogen-bonded complexes
1997
Infra-red cryogenic studies. Part 2.—Effect of matrix environment on hydrogen halide monomers
1969
Vibrational spectra and structures of the water dimer and trimer
1981
Molecular complexes between hydrogen sulphide and water studied by matrix isolation infrared spectroscopy
1984
Ibrational spectra of maleimide, N-deuterated maleimide and maleic anhydride in low-temperature matrices
1977
Studies of intermolecular interactions by matrix isolation vibrational spectroscopy and normal coordinate analysis
1978
Vibrational Spectra of Maleimide and Barbituric Acid in Low‐Temperature Matrices
1978
Alkene‐halogen complexes studied by matrix isolation vibrational spectroscopy
1982
Conformational behaviour of dimethylmethylphosphonate and methyldimethylphosphinate studied by infrared spectroscopy in low-temperature matrices
1983
Polarized infrared spectra of potassium hydrogen maleate and potassium deuterium maleate single crystals
1992
Trihalogenomethane - base complexes studied by vibrational spectroscopy in low-temperature matrices
1982
Infra-red cryogenic studies. Part 7.—Hydrogen sulphide in matrices
1972
Infra-red cryogenic studies. Part 3.—Hydrogen halides in doped argon matrices
1969
Studies of intermolecular interactions by matrix isolation vibrational spectroscopy
1978
Infra-red cryogenic studies. Part 5.—Ethanol and ethanol-d argon matrices
1970
Infra-red cryogenic studies. Part 4.—Isotopically substituted methanols in argon matrices
1970
Molecular complexes of the hydrogen halides studied by matrix isolation infrared spectroscopy
1983