Citation Impact
Citing Papers
Rotational band contour analysis of the O00bands of theÃ1A′-X1A′ electronic systems ofp-fluoro- andp-chlorostyrene: Hybrid character and geometry changes
1973
Constraining the electron densities in DFT method as an effective way forab initio studies of metal-catalyzed reactions
2000 StandoutNobel
Studies of Proton Translocations in Biological Systems: Simulating Proton Transport in Carbonic Anhydrase by EVB-Based Models
2004 StandoutNobel
Highly efficient organic light-emitting diodes from delayed fluorescence
2012 StandoutNature
On the origin of the catalytic power of carboxypeptidase A and other metalloenzymes
2009 StandoutNobel
The EVB as a quantitative tool for formulating simulations and analyzing biological and chemical reactions
2009 StandoutNobel
At the dawn of the 21st century: Is dynamics the missing link for understanding enzyme catalysis?
2009 StandoutNobel
Vibrational relaxation in jet-cooled phenylalkynes
1981 StandoutNobel
Copper(I) and copper(II) complexes of entwined or interlocked phenanthroline type ligands: ESR and crystallographic investigations
1990 StandoutNobel
Photoremovable Protecting Groups in Chemistry and Biology: Reaction Mechanisms and Efficacy
2012 Standout
Photodissociation of acetylene: Determination of D00 (HCC–H) by photofragment imaging
1990
Ionization potentials of HCN and HNC by a Green's function method
1976
Rotational analysis of the A ← X system of C2H
1985 StandoutNobel
Unusual low-energy isomers for simple radical cations
1983 StandoutNobel
Vibrational spectra of styrene-H8, -D3, -D5, and -D8
1976
Gaussian-2 theory for molecular energies of first- and second-row compounds
1991 StandoutNobel
Syntheses and properties of cis- and trans-dialkynyl complexes of platinum(II)
1978
Theoretical study of Si2Hn (n=0–6) and Si2H+n (n=0–7): Appearance potentials, ionization potentials, and enthalpies of formation
1991 StandoutNobel
Ground state vibrational randomization in alkylbenzenes
1983 StandoutNobel
Mechanism of Soot Formation in Acetylene-Oxygen Mixtures
1986
Vibrational relaxation in jet-cooled phenoxyalkanes
1981 StandoutNobel
Two-photon A←X spectra of benzonitrile and styrene vapors: Tests of perturbation rules
1983
Recent research and development of combustion simulation
2001 StandoutNobel
Gaussian-1 theory of molecular energies for second-row compounds
1990 StandoutNobel
Theoretical study of the U.V. spectrum of acetylene
1987
Single-crystal ESR spectra of copper(II) complexes with geometries intermediate between a square pyramid and a trigonal bipyramid
1978
On the bonding and reactivity of CO2 on metal surfaces
1986
Ab initio calculations of the inversion vibrational states of NF3+
1985
Picosecond dynamics and photoisomerization of stilbene in supersonic beams. I. Spectra and mode assignments
1984 StandoutNobel
Formation of polycyclic aromatic hydrocarbons and their growth to soot—a review of chemical reaction pathways
2000 Standout
Comparison of correlation effects on the inversion barriers in CF3 and NF3+ from perturbation theory and configuration interaction
1987 StandoutNobel
Lowest excited triplet states of 1,2- and 1,4-dicyanobenzenes by low-temperature matrix-isolation infrared spectroscopy and density-functional-theory calculation
2003
Metal cluster ion photofragmentation
1986 StandoutNobel
Femtosecond pump–probe photoelectron spectroscopy of predissociative Rydberg states in acetylene
2000 StandoutNobel
Jet-cooled styrene: spectra and isomerization
1983 StandoutNobel
Infrared kinetic spectroscopy of C2H and C2D
1988 StandoutNobel
Theoretical Calculations on Excited Electronic States of Benzaldehyde and Observation of the S2←S0 Jet-Cooled Spectrum
1996
Color center laser spectroscopy of C2H and C2D
1987 StandoutNobel
Pseudopotential study of monohydrides and monoxides of main group elements K through Br
1988
Vibrational assignments in the 288 nm A′-A′ electronic absorption spectrum of styrene: New information on the C(1)-C(α) torsional vibrational levels in the ground electronic state of styrene, styrene-β-D2, and p-fluorostyrene
1978
Semiempirical potential surfaces and dynamical considerations for collisions between alkali metals and molecular oxygen: Li+O2 and Na+O2
1978
Theoretical study of the C–H bond dissociation energy of acetylene
1989 StandoutNobel
Trajectory surface-hopping study of the K + O2 collision: Energy transfer in neutral and ionic products
1983
Multiphoton Absorbing Materials: Molecular Designs, Characterizations, and Applications
2008 Standout
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
Force constants of small molecules
1963
The empirical valence bond model: theory and applications
2011 StandoutNobel
On Unjustifiably Misrepresenting the EVB Approach While Simultaneously Adopting It
2009 StandoutNobel
Halogen oxides: Radicals, sources and reservoirs in the laboratory and in the atmosphere
1995 StandoutNobel
The predissociation of highly excited states in acetylene by time-resolved photoelectron spectroscopy
2003 StandoutNobel
Predictions of the rotational and vibrational spectra of SiF+, PO+, and NS+ by Mo/ller–Plesset perturbation theory
1988
Effective way of modeling chemical catalysis: Empirical valence bond picture of role of solvent and catalyst in alkylation reactions
2000 StandoutNobel
Theoretical equilibrium geometry, vibrational frequencies and the first electronic transition energy of HCC
1983
(3+1) -resonantly enhanced multiphoton ionization-photoelectron spectroscopy of the (3d-4s) supercomplex of acetylene: The geometry of the E state revisited through experiment and theory
2003
Calculations of Activation Entropies of Chemical Reactions in Solution
2000 StandoutNobel
Color center laser spectroscopy of vibrationally excited C2H
1987 StandoutNobel
Extended CNDO calculations upon styrene and aniline
1972
Intramolecular vibrational relaxation: Effects on electronic nonradiative relaxation rates
1983 StandoutNobel
Intramolecular energy transfer in cis-trans isomerization: A study of fluorescence from single vibronic levels of styrene, trans-β-styrene-d1, styrene-d8, and ethynlbenzene
1974
Reaction Dynamics of Electronically Excited Alkali Atoms with Simple Molecules
1985 StandoutNobel
Multiconfiguration molecular mechanics algorithm for potential energy surfaces of chemical reactions
2000
Reaction mechanism of soot formation in flames
2002 Standout
Density matrix averaged atomic natural orbital (ANO) basis sets for correlated molecular wave functions
1990 Standout
Velocity map imaging of ions and electrons using electrostatic lenses: Application in photoelectron and photofragment ion imaging of molecular oxygen
1997 Standout
Energy refinement of hen egg-white lysozyme
1974 StandoutNobel
Photodissociation spectroscopy and dynamics of negative ion clusters. II. CO3−⋅(H2O)1,2,3
1985
Theoretical studies of AlF, AlCl, and AlBr
1988
CO2 photo-reduction: insights into CO2 activation and reaction on surfaces of photocatalysts
2016 Standout
Dynamics of nonadiabatic reactions (theory). I. Branching ratios for early and late seams
1985 StandoutNobel
A theoretical study, including correlation, of the low-lying states of the ethynyl radical
1975
Works of S.P. So being referenced
Structure and bonding of carbon and nitrogen trifluorides
1979
Excited singlet electronic states of acetylene: c i s and t r a n s structures and energetics
1980
Low-lying electronic states of the ethynyl free radical
1975
Ethynylbenzene calculations of energies of electronic states
1971
Low-lying electronic states of HCN+ and the interpretation of the photoelectron spectrum of HCN
1975
Allowed and forbidden components in the 2790 Å system of ethynylbenzene
1970
A theoretical study of the excited electronic states of AlF
1974
Ethynylbenzene analysis of the 2790 Å absorption system
1971
Normal coordinate analysis of the fluorosulphate radical and anion in the Urey-Bradley force field
1972
Ground electronic state and geometry of the CO ? 3 radical anion
1976
The electronic ground states of alkali monoxides
1975
The structure of BF−3
1977
Ethynylbenzene; The vibrational spectra of some deuterated isomers
1970