JOURNAL OF CHEMICAL PHYSICS - Texas A&M University (TAMU) Scholar

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Angle-independent plasmonic substrates for multi-mode vibrational strong coupling with molecular thin films. 154:104305-104305. 2021
Liquid state properties of SEI components in dimethoxyethane. 155:124701-124701. 2021
Localized high concentration electrolytes decomposition under electron-rich environments. 154:104702-104702. 2021
Polyamorphism in vapor-deposited 2-methyltetrahydrofuran: A broadband dielectric relaxation study. 154:024502-024502. 2021
A study of the translational temperature dependence of the reaction rate constant between CH3CN and Ne+ at low temperatures. 153:124305-124305. 2020
Comparing steady state photothermalization dynamics in copper and gold nanostructures. 152:061101-061101. 2020
Comparison of intermolecular energy transfer from vibrationally excited benzene in mixed nitrogen–benzene baths at 140 K and 300 K. 153:144116-144116. 2020
Disentangling different modes of mobility for triphenylphosphine oxide adsorbed on alumina. 152:054718-054718. 2020
Distinguishing resonance symmetries with energy-resolved photoion angular distributions from ion-pair formation in O2 following two-photon absorption of a 9.3 eV femtosecond pulse. 153:021103-021103. 2020
Impact of particle arrays on phase separation composition patterns. 152:224902-224902. 2020
Li2S growth on graphene: Impact on the electrochemical performance of Li-S batteries. 152:014701-014701. 2020
Physical vapor deposition of a polyamorphic system: Triphenyl phosphite. 153:124511-124511. 2020
Size-dependent dark exciton properties in cesium lead halide perovskite quantum dots. 153:184703-184703. 2020
The importance of O3 excited potential energy surfaces in O2–O high-temperature kinetics. 152:044305-044305. 2020
A comprehensive assessment of the low-temperature thermal properties and thermodynamic functions of CeO2. 151:044202-044202. 2019
Dielectric properties of vapor-deposited propylbenzenes. 151:174503-174503. 2019
Discovery of blue singlet exciton fission molecules via a high-throughput virtual screening and experimental approach. 151:121102-121102. 2019
Dissociative photoionization of NO across a shape resonance in the XUV range using circularly polarized synchrotron radiation. 151:174305-174305. 2019
Energetic hot electrons from exciton-to-hot electron upconversion in Mn-doped semiconductor nanocrystals. 151:120901-120901. 2019
Evidence for lambda doublet propensity in the UV photodissociation of ozone. 151:224302-224302. 2019
Heavy-atom effects on intramolecular singlet fission in a conjugated polymer. 151:044902-044902. 2019
Hypervelocity cluster ion impacts on free standing graphene: Experiment, theory, and applications. 150:160901-160901. 2019
On the determination of absorption cross section of colloidal lead halide perovskite quantum dots. 151:154706-154706. 2019
Probing molecular bond-length using molecular-frame photoelectron angular distributions. 150:174306-174306. 2019
Relationship between aged and vapor-deposited organic glasses: Secondary relaxations in methyl-m-toluate. 151:144502-144502. 2019
Type-II heterostructures of α-V2O5 nanowires interfaced with cadmium chalcogenide quantum dots: Programmable energetic offsets, ultrafast charge transfer, and photocatalytic hydrogen evolution. 151:224702-224702. 2019
Ultrastable and polyamorphic states of vapor-deposited 2-methyltetrahydrofuran. 150:214502-214502. 2019
Comparison of KBr and NaCl effects on the glass transition temperature of hydrated layer-by-layer assemblies. 149:163317-163317. 2018
Nascent O2 (a 1Δg, v = 0, 1) rotational distributions from the photodissociation of jet-cooled O3 in the Hartley band. 149:134309-134309. 2018
Non-statistical intermolecular energy transfer from vibrationally excited benzene in a mixed nitrogen-benzene bath. 149:134101-134101. 2018
Vibrational energy transfer and dissociation in O2–N2 collisions at hyperthermal temperatures. 148:084309-084309. 2018
When Hartree-Fock exchange admixture lowers DFT-predicted barrier heights: Natural bond orbital analyses and implications for catalysis. 148:244106-244106. 2018
“Trampoline” ejection of organic molecules from graphene and graphite via keV cluster ions impacts. 148:144309-144309. 2018
Modifying hydrogen-bonded structures by physical vapor deposition: 4-methyl-3-heptanol. 147:194504-194504. 2017
A method of extracting speed-dependent vector correlations from 2 + 1 REMPI ion images. 147:013947-013947. 2017
Why are GGAs so accurate for reaction kinetics on surfaces? Systematic comparison of hybrid vs. nonhybrid DFT for representative reactions. 146:234103-234103. 2017
Two-photon-absorption line strengths for nitric oxide: Comparison of theory and sub-Doppler, laser-induced fluorescence measurements. 146:124311-124311. 2017
Ejection-ionization of molecules from free standing graphene. 146:084308-084308. 2017
The collision of a hypervelocity massive projectile with free-standing graphene: Investigation of secondary ion emission and projectile fragmentation. 146:054305-054305. 2017
Two-body perturbation theory versus first order perturbation theory: A comparison based on the square-well fluid. 147:214108-214108. 2017
Silicon-wall interfacial free energy via thermodynamics integration. 145:184702-184702. 2016
Conformation-specific spectroscopy of alkyl benzyl radicals: Effects of a radical center on the CH stretch infrared spectrum of an alkyl chain. 145:124314-124314. 2016
Anisotropic parallel self-diffusion coefficients near the calcite surface: A molecular dynamics study. 145:084702-084702. 2016
Pseudogap and anharmonic phonon behavior in Ba8Ga16Ge30: An NMR study. 145:054702-054702. 2016
System-size corrections for self-diffusion coefficients calculated from molecular dynamics simulations: The case of CO2, n-alkanes, and poly(ethylene glycol) dimethyl ethers. 145:074109-074109. 2016
Influence of surface vacancy defects on the carburisation of Fe 110 surface by carbon monoxide. 145:044710-044710. 2016
Photodissociation dynamics of OCS near 214 nm using ion imaging. 145:024310-024310. 2016
Resolving the energy and temperature dependence of C6H6∗ collisional relaxation via time-dependent bath temperature measurements. 145:014308-014308. 2016
Thermal relaxation of molecular oxygen in collisions with nitrogen atoms. 145:014309-014309. 2016
Anharmonic modeling of the conformation-specific IR spectra of ethyl, n-propyl, and n-butylbenzene. 144:224310-224310. 2016
Quantum and quasi-classical collisional dynamics of O2–Ar at high temperatures. 144:234311-234311. 2016
Lattice constants of pure methane and carbon dioxide hydrates at low temperatures. Implementing quantum corrections to classical molecular dynamics studies. 144:124512-124512. 2016
Rovibrational energy transfer and dissociation in O2–O collisions. 144:104301-104301. 2016
Erratum: “Quantum and quasi-classical collisional dynamics of O2–Ar at high temperatures” [J. Chem. Phys. 144, 234311 (2016)]. 145:239902-239902. 2016
High order harmonic generation from SF6: Deconvolution of macroscopic effects. 145:224305-224305. 2016
Infrared laser spectroscopy of the n-propyl and i-propyl radicals: Stretch-bend Fermi coupling in the alkyl CH stretch region. 145:224304-224304. 2016
Quantum dynamics on a three-sheeted six-dimensional ab initio potential-energy surface of the phosphine cation: Simulation of the photoelectron spectrum and the ultrafast radiationless decay dynamics. 143:194301-194301. 2015
Single impacts of keV fullerene ions on free standing graphene: Emission of ions and electrons from confined volume. 143:164302-164302. 2015
The role of intermolecular interactions in the prediction of the phase equilibria of carbon dioxide hydrates. 143:094506-094506. 2015
Hypervelocity nanoparticle impacts on free-standing graphene: A sui generis mode of sputtering. 142:044308-044308. 2015
Prediction of the phase equilibria of methane hydrates using the direct phase coexistence methodology. 142:044501-044501. 2015
Collision induced ultraviolet structure in nitrogen radar REMPI spectra. 141:244301-244301. 2014
Molecular simulation of thermodynamic and transport properties for the H2O+NaCl system. 141:234507-234507. 2014
High-resolution photoabsorption spectrum of jet-cooled propyne. 141:114303-114303. 2014
Brownian dynamics simulations of nanosheet solutions under shear. 141:024905-024905. 2014
Equilibrium limit of thermal conduction and boundary scattering in nanostructures. 140:244112-244112. 2014
A unified model for simulating liquid and gas phase, intermolecular energy transfer: N2 + C6F6 collisions. 140:194103-194103. 2014
Interchannel coupling effects in the valence photoionization of SF6. 140:204305-204305. 2014
Theoretical calculations and vibrational potential energy surface of 4-silaspiro(3,3)heptane. 140:164315-164315. 2014
Fluorescence excitation and ultraviolet absorption spectra and theoretical calculations for benzocyclobutane: Vibrations and structure of its excited S1(π,π*) electronic state. 140:034305-034305. 2014
Low-temperature collisional quenching of NO A2Σ+(v′ = 0) by NO(X2Π) and O2 between 34 and 109 K. 141:074313-074313. 2014
The complex scaled multiconfigurational time-dependent Hartree-Fock method for studying resonant states: Application to the 2 s2 He Feshbach resonance. 140:094305-094305. 2014
Vibrationally specific photoionization cross sections of acrolein leading to the X̃A′2 ionic state. 141:094301-094301. 2014
A theoretical study of hydrated molecular clusters of amines and dicarboxylic acids. 139:064312-064312. 2013
Direct measurements of collisionally broadened Raman linewidths of CO2 S-branch transitions. 138:024201-024201. 2013
Measuring the internal energies of species emitted from hypervelocity nanoprojectile impacts on surfaces using recalibrated benzylpyridinium probe ions. 138:214301-214301. 2013
On calculation of thermal conductivity from Einstein relation in equilibrium molecular dynamics. 137:014106-014106. 2012
Communication: Phase transitions, criticality, and three-phase coexistence in constrained cell models. 136:201101-201101. 2012
Electron scattering by methanol and ethanol: A joint theoretical-experimental investigation. 136:114311-114311. 2012
Erratum: “A method for the determination of speed-dependent semi-classical vector correlations from sliced image anisotropies” [J. Chem. Phys. 135, 094201 (2011)]. 136:219901-219901. 2012
Near-threshold shape resonance in the photoionization of 2-butyne. 136:154303-154303. 2012
A method for the determination of speed-dependent semi-classical vector correlations from sliced image anisotropies. 135:094201-094201. 2011
Control of nitromethane photoionization efficiency with shaped femtosecond pulses. 134:154301-154301. 2011
Nanocatalyst structure as a template to define chirality of nascent single-walled carbon nanotubes. 134:014705-014705. 2011
Paired hydrogen bonds in the hydrogen halide homodimer (HI)2. 134:064317-064317. 2011
Recrystallization of picosecond laser-melted ZnO nanoparticles in a liquid: A molecular dynamics study. 132:164504-164504. 2010
Polypeptides in alpha-helix conformation perform as diodes. 132:065102-065102. 2010
A ground state morphed intermolecular potential for the hydrogen bonded and van der Waals isomers in OC:HI and a prediction of an anomalous deuterium isotope effect. 133:184305-184305. 2010
Electronic-resonance-enhanced coherent anti-Stokes Raman scattering of nitric oxide: Saturation and Stark effects. 133:084310-084310. 2010
Input vector optimization of feed-forward neural networks for fitting ab initio potential-energy databases. 132:204103-204103. 2010
Shell-anchor-core structures for enhanced stability and catalytic oxygen reduction activity. 133:134705-134705. 2010
Structural and dynamical analysis of monodisperse and polydisperse colloidal systems. 133:224901-224901. 2010
Vibronics and plasmonics based graphene sensors. 132:125102-125102. 2010
Extrapolated high-order propagators for path integral Monte Carlo simulations. 132:044103-044103. 2010
Erratum: “Ring-breaking electron attachment to uracil: Following bond dissociations via evolving resonances” [J. Chem. Phys. 128, 174302 (2008)]. 131:249901-249901. 2009
Modeling the phase behavior of polydisperse rigid rods with attractive interactions with applications to single-walled carbon nanotubes in superacids. 131:084901-084901. 2009
Mechanism of carbon nanotubes unzipping into graphene ribbons. 131:031105-031105. 2009
DNA origami impedance measurement at room temperature. 130:171101-171101. 2009
Accurate prediction of higher-level electronic structure energies for large databases using neural networks, Hartree–Fock energies, and small subsets of the database. 131:124127-124127. 2009
Computing the viscosity of supercooled liquids. 130:224504-224504. 2009
Computing the viscosity of supercooled liquids. II. Silica and strong-fragile crossover behavior. 131:164505-164505. 2009
Development of generalized potential-energy surfaces using many-body expansions, neural networks, and moiety energy approximations. 130:184102-184102. 2009
Mode-specific photoionization dynamics of a simple asymmetric target: OCS. 130:044302-044302. 2009
Molecular biosensor based on a coordinated iron complex. 130:105101-105101. 2009
Nanotube nucleation versus carbon-catalyst adhesion–Probed by molecular dynamics simulations. 131:224501-224501. 2009
Phase equilibrium of colloidal suspensions with particle size dispersity: A Monte Carlo study. 130:194902-194902. 2009
Protonation of O2 adsorbed on a Pt3 island supported on transition metal surfaces. 131:044709-044709. 2009
Simultaneous fitting of a potential-energy surface and its corresponding force fields using feedforward neural networks. 130:134101-134101. 2009
Spectroscopic investigations and potential energy surfaces of the ground and excited electronic states of 1,3-benzodioxan. 131:044302-044302. 2009
Structure of polyamidoamide dendrimers up to limiting generations: A mesoscale description. 130:144902-144902. 2009
Accurate solid-state band gaps via screened hybrid electronic structure calculations. 129:011102-011102. 2008
Impedance measurements on a DNA junction. 128:201103-201103. 2008
Local reactivity of O2 with Pt3 on Co3Pt and related backgrounds. 128:204701-204701. 2008
Molecular dynamics simulations of thermal resistance at the liquid-solid interface. 129:174701-174701. 2008
Multivariate analysis of homogeneous nucleation rate measurements. Nucleation in the p-toluic acid/sulfuric acid/water system. 128:064508-064508. 2008
Nanomicrointerface to read molecular potentials into current-voltage based electronics. 128:114711-114711. 2008
Parametrization of analytic interatomic potential functions using neural networks. 129:044111-044111. 2008
Perturbative theory and modeling of electronic-resonance-enhanced coherent anti-Stokes Raman scattering spectroscopy of nitric oxide. 128:174308-174308. 2008
Polarization and interactions of colloidal particles in ac electric fields. 129:064513-064513. 2008
Ring-breaking electron attachment to uracil: Following bond dissociations via evolving resonances. 128:174302-174302. 2008
Biatomic substrates for bulk-molecule interfaces: The PtCo-oxygen interface. 127:244706-244706. 2007
Calculation of conformation-dependent biomolecular forces. 127:175104-175104. 2007
Density functional theory for the photoionization dynamics of uracil. 127:234317-234317. 2007
Direct approach for the electron transport through molecules. 127:111106-111106. 2007
Effect of nuclear motion on the absorption spectrum of dipicolinic acid. 126:024502-024502. 2007
Electronic and structural properties of oligophenylene ethynylenes on Au(111) surfaces. 126:184706-184706. 2007
Experimental and theoretical study of reactivity trends for methanol on Co∕Pt(111) and Ni∕Pt(111) bimetallic surfaces. 127:114707-114707. 2007
Initial stage of spinodal decomposition in a rigid-rod system. 126:034903-034903. 2007
Mobile trap algorithm for zinc detection using protein sensors. 127:185102-185102. 2007
Molecular dynamics simulations of signal transmission through a glycine peptide chain. 127:134708-134708. 2007
Molecular frame and recoil frame photoelectron angular distributions from dissociative photoionization of NO2. 126:054307-054307. 2007
Quasibound continuum states in SiF4 (D̃A12) photoionization: Photoelectron-vibrational coupling. 126:244309-244309. 2007
Vibrationally resolved photoionization dynamics of CF4 in the DA12 state. 127:044312-044312. 2007
Computation of the nonhomogeneous equilibrium states of a rigid-rod solution. 125:214906. 2006
Gradient symplectic algorithms for solving the radial Schrödinger equation. 124:054106-054106. 2006
Anisotropy of photofragment recoil as a function of dissociation lifetime, excitation frequency, rotational level, and rotational constant. 125:133316-133316. 2006
Coaxial carbon nanotubes as shielded nanowires. 124:041101-041101. 2006
Computation of the nonhomogeneous equilibrium states of a rigid-rod solution. 125:214906-214906. 2006
Fluorescence and ultraviolet absorption spectra and structure of coumaran and its ring-puckering potential energy function in the S1(π,π*) excited state. 125:034308-034308. 2006
Friction and tribochemical reactions occurring at shearing interfaces of nanothin silver films on various substrates. 124:174703-174703. 2006
Intensity enhancement of the vibrational spectrum of oxygen when attached to a platinum nanocluster. 125:174302-174302. 2006
Launching a particle on a ring: b2u→ke2g ionization of C6F6. 125:164316-164316. 2006
Linear-scaling calculation of static and dynamic polarizabilities in Hartree-Fock and density functional theory for periodic systems. 125:224105-224105. 2006
Photodissociation of the BrO radical using velocity map ion imaging: Excited state dynamics and accurate D00(BrO) evaluation. 124:134304-134304. 2006
Temperature-induced crystallization in concentrated suspensions of multiarm star polymers: A molecular dynamics study. 124:044905-044905. 2006
Transient behavior at the nanoscale. 124:171102-171102. 2006
Assessment of phenomenological models for viscosity of liquids based on nonequilibrium atomistic simulations of copper. 123:104506-104506. 2005
Fluorescence correlation spectroscopy studies of diffusion of a weak polyelectrolyte in aqueous solutions. 122:014907-014907. 2005
Ozonolysis of α-pinene and β-pinene: Kinetics and mechanism. 122:114308-114308. 2005
Photoelectron trapping in N2O 7σ→kσ resonant ionization. 123:014307-014307. 2005
Prediction of molecular-dynamics simulation results using feedforward neural networks: Reaction of a C2 dimer with an activated diamond (100) surface. 123:224711-224711. 2005
The UV photodissociation dynamics of ClO radical using velocity map ion imaging. 123:174303-174303. 2005
A finite temperature linear tetrahedron method for electronic structure calculations of periodic systems. 121:2466-2470. 2004
Dissociative photoionization of N2O in the region of the N2O+(B 2Π) state studied by ion–electron velocity vector correlation. 120:8226-8240. 2004
Fast semiempirical calculations for nuclear magnetic resonance chemical shifts: A divide-and-conquer approach. 120:11392-11400. 2004
Low-energy electron scattering by cubane: Resonant states and Ramsauer–Townsend features from quantum calculations in the gas phase. 120:4172-4181. 2004
Mode-specific photoelectron scattering effects on CO2+(C 2Σg+) vibrations. 120:612-622. 2004
Modification of the surface electronic and chemical properties of Pt(111) by subsurface 3d transition metals. 120:10240-10246. 2004
Near threshold photoionization of the ground and first excited states of C2. 120:6010-6018. 2004
Near-infrared spectra and rovibrational dynamics on a four-dimensional ab initio potential energy surface of (HBr)2. 120:10426-10441. 2004
Radiation damage of biosystems mediated by secondary electrons: Resonant precursors for uracil molecules. 120:7446-7455. 2004
The trust-region self-consistent field method: Towards a black-box optimization in Hartree–Fock and Kohn–Sham theories. 121:16-27. 2004
Dynamical multiple-time stepping methods for overcoming resonance instabilities. 120:8-13. 2004
Criteria for formation of metallic glasses: The role of atomic size ratio. 119:9858-9870. 2003
Studies of Ar:HBr using fast scan submillimeter-wave and microwave coaxial pulsed jet spectrometers with sub-kHz precision. 119:10687-10695. 2003
The role of triplet states in the long wavelength absorption region of bromine nitrate. 119:7864-7870. 2003
Effect of cyclic chain architecture on properties of dilute solutions of polyethylene from molecular dynamics simulations. 119:1843-1854. 2003
Complete description of linear molecule photoionization achieved by vector correlations using the light of a single circular polarization. 118:9653-9663. 2003
Trapped metastable anions in low-energy electron scattering from C20 clusters. 118:4013-4024. 2003
Detailed dynamics of a complex photochemical reaction: Cis–trans photoisomerization of stilbene. 119:10658-10666. 2003
Laser-induced fluorescence, electronic absorption, infrared and Raman spectra, and ab initio calculations of 1,2-dihydronaphthalene: Investigation of the out-of-plane ring modes for the ground and S1(π,π*) excited states. 119:2557-2568. 2003
C–C bond fission pathways of chloroalkenyl alkoxy radicals. 118:1794-1801. 2003
Supramolecular structure of helical ribbons self-assembled from a β-sheet peptide. 118:389-397. 2003
Vector correlations in dissociative photoionization of O2 in the 20–28 eV range. II. Polar and azimuthal dependence of the molecular frame photoelectron angular distribution. 117:8368-8384. 2002
First principles determination of the photoelectron spectrum of LiH−. 117:5757-5763. 2002
Gradient symplectic algorithms for solving the Schrödinger equation with time-dependent potentials. 117:1409-1415. 2002
Gas phase trapped ion studies of collisionally formed MgC60+ complexes. 116:10201-10211. 2002
Unimolecular decomposition of nitrooxyalkyl radicals from NO3–isoprene reaction. 116:9721-9728. 2002
Theoretical studies of cross sections and photoelectron angular distributions in the valence photoionization of molecular oxygen. 116:8863-8875. 2002
Probing the nature of the K-rotor in unimolecular reactions: Scalar and vector correlations in the photodissociation of NCNO. 116:7027-7034. 2002
Spectroscopic determination of the two-dimensional vibrational potential energy surfaces for the ring-puckering and ring-flapping modes of indan in its S0 and S1(π,π*) electronic states. 116:6648-6655. 2002
The ultraviolet photodissociation of jet-cooled ClO and BrO radicals. 116:4176-4183. 2002
Low-energy resonant structures in electron scattering from C20 fullerene. 116:2811-2824. 2002
Dissociative photoionization of N2O in the region of the N2O+(C 2Σ+) state, studied by ion–electron velocity vector correlation. 117:9248-9257. 2002
Total cross sections and molecular frame photoelectron angular distributions in the N 1s photoionization of N2: An investigation of electron correlation effects. 117:4348-4360. 2002
Analysis of a dinitro-based molecular device. 116:1671-1683. 2002
Calculation of the chemical potential of chain molecules using the staged particle deletion scheme. 115:8231-8237. 2001
A fourth-order real-space algorithm for solving local Schrödinger equations. 115:6841-6846. 2001
Structure and thermodynamic stability of the OsC and OsC2 molecules by theoretical calculations and by Knudsen cell mass spectrometry. 115:4496-4501. 2001
Differentiation of the ground vibrational and global minimum structures in the Ar:HBr intermolecular complex. 115:899-911. 2001
Melting and crystallization in Ni nanoclusters: The mesoscale regime. 115:385-394. 2001
Studies of angular distributions and cross sections for photodetachment from the oxygen molecular anion. 114:9350-9360. 2001
Fourth order gradient symplectic integrator methods for solving the time-dependent Schrödinger equation. 114:7338-7341. 2001
Resonantly amplified vibronic symmetry breaking. 114:8240-8243. 2001
Electron propagator method with a multiconfigurational second-order perturbation theory wave function as the initial state in the fermion operator block. 114:5124-5136. 2001
Electron scattering from gaseous SF6: Comparing calculations with experiments. 114:3429-3439. 2001
Excitation of the symmetry forbidden bending mode in molecular photoionization. 114:4496-4504. 2001
Separation of spin–orbit coupled metastable states of Kr+ and Xe+ by ion mobility. 114:1709-1715. 2001
Angular distributions of scattered electrons from gaseous benzene molecules. 113:10044-10050. 2000
Quantum yields and energy partitioning in the ultraviolet photodissociation of 1,2 dibromo-tetrafluoroethane (Halon-2402). 113:7149-7157. 2000
Reactions of O2+ with OH-isoprene adduct isomers: Exothermicity, product ions, and rate constants. 113:8574-8579. 2000
Thermal conductivity of diamond and related materials from molecular dynamics simulations. 113:6888-6900. 2000
Chlorine atom addition reaction to isoprene: A theoretical study. 113:153-157. 2000
Purely theoretical electron-impact ionization cross-sections of silicon hydrides and silicon fluorides obtained from explicitly correlated methods. 113:8-17. 2000
Structure and dynamics of N2–IH. 113:249-257. 2000
Fluorescence and electronic absorption spectra of phthalan: Two-dimensional vibrational potential energy surface for the ring-puckering and flapping in the S1(π,π*) state. 112:6700-6706. 2000
Photofragment translational spectroscopy with state-selective “universal detection:” The ultraviolet photodissociation of CS2. 112:5301-5307. 2000
Resolving the controversy over the second ionization potential of the nitrate free radical NO3. 112:4572-4578. 2000
Multichannel Schwinger study of C 1s photoionization of acetylene. 113:1843-1851. 2000
Periodic ab initio calculations of orthoboric acid. 113:3338-3343. 2000
Ab initio study of OH addition reaction to isoprene. 113:5354-5360. 2000
One-particle resonances in low-energy electron scattering from C60. 111:6769-6786. 1999
Photodissociation dynamics of CH2BrCl studied using resonance enhanced multiphoton ionization (REMPI) with time-of-flight mass spectrometry. 111:5771-5779. 1999
The outer valence photoionization of acetylene. 111:6290-6299. 1999
The structure and ground state dynamics of Ar–IH. 111:5764-5770. 1999
Vector signatures of adiabatic and diabatic dynamics in the photodissociation of ICN. 111:6735-6749. 1999
Adsorption of human serum albumin: Dependence on molecular architecture of the oppositely charged surface. 110:10153-10161. 1999
The unimolecular dissociation of vinylcyanide: A theoretical investigation of a complex multichannel reaction. 110:2862-2871. 1999
The unimolecular dissociation of vinylcyanide: A theoretical investigation of a complex multichannel reaction. 110:2862-2871. 1999
The near ultraviolet dissociation dynamics of azomethane: Correlated V-T energy disposal and product appearance times. 109:7238-7245. 1998
Kinetic regimes of polyelectrolyte exchange between the adsorbed state and free solution. 109:6869-6878. 1998
Polyelectrolyte adsorption onto an initially-bare solid surface of opposite electrical charge. 109:6861-6868. 1998
Far-infrared spectra and two-dimensional potential energy surfaces for the out-of-plane ring vibrations of tetrahydrofuran-3-one in its S0 and S1(n,π*) electronic states. 108:8884-8890. 1998
One-electron resonances and computed cross sections in electron scattering from the benzene molecule. 108:6144-6159. 1998
Photodissociation of acrylonitrile at 193 nm: A photofragment translational spectroscopy study using synchrotron radiation for product photoionization. 108:5784-5794. 1998
Primary and secondary processes in the 193 nm photodissociation of vinyl chloride. 108:5414-5425. 1998
Far-infrared and combination-band spectra of the ring-puckering and ring-flapping vibrations of phthalan: A failure of the one-dimensional model. 108:3531-3536. 1998
Low-energy electron scattering from the water molecule: Angular distributions and rotational excitation. 108:4002-4012. 1998
Two-dimensional vibrational potential energy surface for phthalan: The effect of large coupling on vibrational quantum states. 108:3537-3542. 1998
Chirped pulse enhancement of multiphoton absorption in molecular iodine. 108:2309-2313. 1998
Short-range effects in resonant electron–molecule scattering from van der Waals clusters. 107:8483-8490. 1997
The validity of the hard-sphere model in hydrogen bonded intermolecular interactions of HCN–HF. 107:8327-8337. 1997
A small optimal complete active space (CAS) for multiconfigurational spin tensor electron propagator method (MCSTEP) ionization potentials: Application to methane, acetylene, ethylene, and ethane. 107:5088-5093. 1997
Interbranch line-mixing in CO2 (1001) and (0201) combination bands. 107:5995-6004. 1997
Monte Carlo studies of effects of substrate size on water–substrate interaction energy and water structure. 107:5212-5216. 1997
Quantum control of I2 in the gas phase and in condensed phase solid Kr matrix. 106:8486-8503. 1997
Time domain modeling of spectral collapse in high density molecular gases. 106:8299-8309. 1997
Laser induced fluorescence spectra and carbonyl wagging potential energy functions for the S 1 (n,π * ) excited states of tetrahydrofuran-3-one and tetrahydrothiophen-3-one: Correlation between inversion barrier and angle strain for cyclic ketones. 106:3876-3883. 1997
Diode laser measurements of CD 3 quantum yields and internal energy for the dissociation of dimethyl sulfoxide-d 6. 106:1346-1352. 1997
Unraveling the dissociation of dimethyl sulfoxide following absorption at 193 nm. 106:539-550. 1997
Vector and scalar correlations in statistical dissociation: The photodissociation of NCCN at 193 nm. 106:60-76. 1997
Low‐lying ionization potentials of O 3 and NO 2 using the multiconfigurational spin tensor electron propagator method. 105:9927-9932. 1996
Accurate vertical ionization potentials of CH 2 , NH 2 , and H 2 O using the multiconfigurational spin tensor electron propagator method (MCSTEP). 105:8170-8177. 1996
Multiplet‐specific multichannel electron‐correlation effects in the photoionization of NO. 104:8989-9000. 1996
The effect of the nature of the interaction potential on cluster reaction rates. 104:9016-9026. 1996
Time resolved heat propagation in a gold crystal by means of picosecond x‐ray diffraction. 104:10001-10007. 1996
Low‐energy electron scattering by halomethanes: Elastic and differential cross sections for CF 4. 104:6482-6490. 1996
Line shape analysis of Doppler broadened frequency‐modulated line spectra. 104:2129-2135. 1996
Quantum phase space theory for the calculation of v⋅j vector correlations. 104:1864-1874. 1996
Wetting of crystalline polymer surfaces: A molecular dynamics simulation. 103:9053-9061. 1995
A graphical unitary group approach to study multiplet specific multichannel electron correlation effects in the photoionization of O 2. 102:8493-8505. 1995
Far‐infrared spectra and two‐dimensional potential energy surface for the ring‐bending and ring‐twisting vibrations of 5,6‐dihydro‐4H‐thiopyran. 102:9506-9511. 1995
Multiconfigurational spin tensor electron propagator vertical ionization potentials for O 2 : Comparison to some other forefront methods using the same basis sets and geometries. 102:9444-9445. 1995
A density functional/molecular dynamics study of the structure of liquid nitromethane. 102:8281-8282. 1995
Jet‐cooled fluorescence excitation spectrum, carbonyl wagging, and ring‐puckering potential energy functions of 3‐cyclopenten‐1‐one in its S 1 ( n ,π*) electronic excited state. 102:7789-7797. 1995
Thermal collision rate constants for small nickel clusters of size 2–14 atoms. 102:7683-7699. 1995
On the scattering of low‐energy electrons by sulphur hexafluoride. 102:5743-5751. 1995
Evidence for stepwise dissociation dynamics in acetone at 248 and 193 nm. 102:4447-4460. 1995
Photodissociation dynamics of the methyl radical 3 s Rydberg state. 102:792-798. 1995
Vibrationally resolved cross sections for the photoionization of CS 2. 101:9548-9557. 1994
Rovibrationally resolved, Fourier‐transform near infrared spectroscopy of the ν 1 and ν 2 vibrations of the HCl dimer in a supersonic jet. 101:4593-4598. 1994
Far‐infrared spectra and two‐dimensional potential energy surfaces for the out‐of‐plane ring vibrations of cyclopentanone in its S 0 and S 1 ( n ,π*) electronic states. 101:2772-2778. 1994
Two‐dimensional vibrational potential energy surface for the ring bending and twisting of 1,3‐oxathiolane. Evidence for the anomeric effect resulting from –O–CH 2 –S– linkages. 101:2740-2745. 1994
Fluorescence spectra and torsional potential functions for trans ‐stilbene in its S 0 and S 1 (π,π*) electronic states. 100:8755-8767. 1994
Calculation of low‐energy elastic cross sections for electron‐CF 4 scattering. 100:6464-6471. 1994
Investigation of the ground vibrational state structure of H 35 Cl trimer based on the resolved K , J substructure of the ν 5 vibrational band. 100:7101-7108. 1994
The potential energy curves of the X 2 Π g , a 4 Π u , A 2 Π u , b 4 Σ − g , B 2 Σ − g , 2. 100:6514-6519. 1994
Jet‐cooled fluorescence excitation spectra and carbonyl wagging and ring‐puckering potential energy functions of cyclobutanone and its 2,2,4,4‐ d 4 isotopomer in the S 1 ( n ,π*) electronic excited state. 100:3455-3462. 1994
Ionization potentials of CH 2 : A comparison of the multiconfigurational spin tensor electron propagator method with benchmark full configuration interaction and large scale multireference configuration interaction calculations. 100:2947-2952. 1994
The potential energy curves of the X²Πg, aⁱ⁴Πu,ia²Πu, b⁴Σg^-, B²Σg^-,²Πu, and c⁴Σu^-states of O2⁺obtained.... 100:6514-6519. 1994
The near ultraviolet photodissociation dynamics of azomethane. 99:4423-4429. 1993
A high repetition rate, picosecond hard x‐ray system, and its application to time‐resolved x‐ray diffraction. 99:869-875. 1993
The effects of collision mass and potential on the energy transfer in thermal collisions of gas phase clusters. 99:1178-1184. 1993
The determination of electron affinities of the open shell systems C and CH 2 using the multiconfigurational spin tensor electron propagator method. 98:8790-8800. 1993
Jet‐cooled fluorescence excitation spectra, conformation, and carbonyl wagging potential energy function of cyclopentanone and its deuterated isotopomers in the S 1 ( n ,π*) electronic excited states. 98:6129-6137. 1993
Spectroscopic characterization of the hydrogen bonded OC–HI in supersonic jets. 98:1761-1767. 1993
Multiconfigurational spin tensor electron propagator electron affinities for F, BO, CN, OH, and NH 2. 97:8441-8448. 1992
Resonances and the effects of interchannel coupling in the photoionization of CS 2. 97:6384-6395. 1992
Inversion of experimental data and ab initio studies of a pseudo‐atom–diatom model for the vibrational dynamics of HCN–HF. 97:2209-2223. 1992
A coincidence counting study of polyatomic ion induced sputtering. 96:8171-8176. 1992
Far‐infrared spectra and hindered pseudorotation of 1,3‐oxathiolane. 96:7298-7305. 1992
Coincidence counting for the study of hydrocarbon ion desorption in plasma desorption mass spectrometry. 96:3206-3210. 1992
Nonlinear programming approach to locally constrained variational calculations: He and H − in the Hartree–Fock approximation. 96:2889-2894. 1992
Dynamic simulations of water at constant chemical potential. 96:1333-1342. 1992
Continuous‐wave supersonic jet diode laser spectroscopy and dynamics of Ar–DCl: Rovibrational analysis of ν1 and ν1+ν12 and the effect of Coriolis coupling in the spectrum of ν1+2ν02. 95:3175-3181. 1991
Charge and spin transfer and optical properties in conducting porphyrin compounds. 95:403-417. 1991
Reply to Comment on: Diffusion theory of multidimensional activated rate processes: The role of anisotropy. 95:1425-1426. 1991
The jet‐cooled fluorescence excitation spectrum and ring‐bending potential‐energy function and conformation of 2‐cyclopenten‐1‐one in the S 1 ( n ,π*) electronic excited state. 94:7734-7743. 1991
Far‐infrared spectra and two‐dimensional potential energy surface for the out‐of‐plane vibrations of 2‐cyclopenten‐1‐one and its deuterated isotopomers. 94:5394-5401. 1991
Collision of hyperthermal atoms with a solid surface. I. Energy dissipation in the solid. 94:4055-4061. 1991
The multiconfigurational particle–particle propagator method for directly determining vertical double ionization potentials and double electron affinities. 94:2884-2893. 1991
Energy barriers of symmetry‐forbidden reactions: Local density functional calculations. 94:1668-1669. 1991
Characteristics and some peculiarities of multiconfigurational self‐consistent field stationary points of the Li − ground state. 93:8011-8020. 1990
Far‐infrared spectra and two‐dimensional potential energy surface of silacyclopentane and its deuterated isotopomers. 93:6291-6302. 1990
Erratum: The multiconfigurational spin tensor electron propagator method: Electron affinities of Li, Na, and K [J. Chem. Phys. 9 1 , 5451 (1989)]. 92:6336-6337. 1990
The multiconfigurational spin tensor electron propagator method (MCSTEP): Electron affinities of Li, Na, and K. 91:5451-5454. 1989
Vibrational spectra and potential energy surface for the ring bending and ring twisting of 5,6‐dihydro‐2H‐thiopyran. 91:2771-2775. 1989
Triplet excitation properties in large scale multiconfiguration linear response calculations. 91:381-388. 1989
Z ‐transition state calculations of energy changes and electrostatic potentials in isoelectronic atoms and molecules. 90:4373-4378. 1989
Diffusion theory of multidimensional activated rate processes: The role of anisotropy. 90:1141-1148. 1989
On the origin of hydrogen clusters produced by particle induced desorption. 89:6708-6712. 1988
Effects of gas‐phase collisions in rapid desorption of molecules from surfaces in the presence of coadsorbates. 89:5251-5263. 1988
Application of the multiconfiguration time‐dependent Hartree–Fock method to CH + : The auxiliary active space. 89:3063-3070. 1988
Accurate transition moments between the A 3 Σ + u , B 3 Π g , and B ’ 3 Σ − u of N 2 using multiconfigurational linear response. 89:1533-1539. 1988
A photodissociation study of 1,3‐butadiene. 89:889-896. 1988
The ionization potentials of NH 2 : The multiconfigurational spin‐tensor electron propagator method (MCSTEP) applied to a polyatomic open‐shell radical. 88:2572-2581. 1988
Accurate transition moments between the A ³Σ u⁺, B³IIg, and B′³Σ u^- of N2 using multiconfigurational linear response. 89:1533-1539. 1988
Alternative modes of conjugation in one‐dimensional polymers. 88:1328-1336. 1988
A comparative study of potential energy surfaces for CH 3 +H 2 ↔CH 4 +H. 87:7024-7035. 1987
Trajectory studies and sensitivity analysis of rotational energy transfer in gas–surface collisions. 87:4170-4179. 1987
The multiconfigurational spin‐tensor electron propagator method for determining vertical principal and shake‐up ionization potentials for open shell and highly correlated atoms and molecules. 87:2925-2944. 1987
Erratum: The ionization potentials of F 2 : A comparison of multiconfigurational electron propagator (MCEP) with other large scale methods using the same basis set [J. Chem. Phys. 8 4 , 284 (1986)]. 87:778-778. 1987
Evidence for resonant intermolecular coupling in liquid benzene and pyridine from Raman difference spectroscopy of isotopic mixtures. 86:4762-4767. 1987
Monte Carlo simulations of gas‐phase collisions in rapid desorption of molecules from surfaces. 86:5816-5824. 1987
Spectroscopic studies of nickel and iron clusters at 12 K. 86:4779-4782. 1987
Matrix and temperature effects on the relaxation of large molecules: A simultaneous time and spectral study. 86:603-609. 1987
Thermal spike model for heavy ion induced desorption from surfaces. 86:443-453. 1987
Excitation energies in Be: A comparison of multiconfigurational linear response and full configuration interaction calculations. 85:6544-6549. 1986
The ionization potentials of F 2 : A comparison of multiconfigurational electron propagator (MCEP) with other large scale methods using the same basis set. 84:284-299. 1986
Stochastic sensitivity analysis applied to gas–surface scattering. 83:3118-3128. 1985
Multiplet‐specific shape resonant features in photoionization of NO. 82:4147-4154. 1985
Effect of pressure on proton transfer rate in aqueous solutions: A picosecond study. 81:5596-5600. 1984
Laser induced thermal desorption from surfaces. 81:6313-6319. 1984
Mechanisms and rate constants for the vibrational relaxation of HD( v =4, 5, and 6) in collisions with HD, 4 He, and D 2. 81:820-827. 1984
The two‐dimensional potential energy surface for the ring puckering and ring twisting of 1‐silacyclopent‐3‐ene‐ d 0 , 1‐ d 1 , and 1, 1‐ d 2. 80:5475-5480. 1984
Large molecule relaxation: Spectroscopy, structure, and vibrational energy redistribution in naphthazarin. 80:4727-4737. 1984
Trajectory studies of vibrational energy transfer in gas–surface collisions. 80:3451-3462. 1984
Studies of the photoionization cross sections of acetylene. 80:1907-1916. 1984
Time‐resolved spectroscopy of intramolecular energy transfer in a rigid spiran. 80:2288-2297. 1984
Multiconfigurational electron propagator (MCEP) ionization potentials for general open shell systems. 80:293-314. 1984
The correlated pi‐Hamiltonian of trans ‐butadiene as calculated by the ab initio effective valence shell Hamiltonian method: Comparison with semiempirical models. 79:3862-3873. 1983
Two‐dimensional analysis of the ring‐puckering and PH inversion vibrations of 3‐phospholene. 79:2103-2113. 1983
Studies of the photoionization cross section of the 2π level of nitric oxide. 79:1360-1363. 1983
Guaranteed convergence in ground state multiconfigurational self‐consistent field calculations. 78:347-356. 1983
Wigner phase‐space description of a Morse oscillator. 77:4604-4610. 1982
Radiationless decay of 1,3,5,7‐octatetraene. 77:3967-3973. 1982
Intersystem crossing and predissociation of haloaromatics. 77:1214-1224. 1982
Cubic contributions in multiconfigurational self‐consistent‐field (MCSCF) calculations. 77:356-370. 1982
Spectroscopy and nonradiative relaxtion of propynal. 77:697-701. 1982
A method to include certain infinite order contributions in a multiconfigurational self‐consistent field (MCSCF) calculation. 76:5388-5396. 1982
The three‐dimensional potential energy surface for the ring‐puckering, ring‐deformation, and SiH 2 rocking vibrations of 1,3‐disilacyclobutane. 76:3890-3898. 1982
Multiconfigurational Hartree–Fock studies of avoided curve crossing using the Newton–Raphson technique. 76:527-542. 1982
Generalizations of Newton–Raphson and multiplicity independent Newton–Raphson approaches in multiconfigurational Hartree–Fock theory. 75:5802-5815. 1981
Picosecond kinetics of p ‐dimethylaminobenzonitrile. 75:5714-5719. 1981
Observation of collisional relaxation from HD v = 5 and v = 6 by direct overtone pumping and photoacoustic detection. 75:4893-4896. 1981
Determination of bandwidth and frequency changes by Raman difference spectroscopy. 75:2539-2545. 1981
Picosecond infrared dynamics of electron trapping in polar liquids. 75:2265-2269. 1981
Lateral interaction effects on the reaction of CO 2 and oxygen adsorbed on Ag(110). 74:4144-4149. 1981
Low‐frequency vibrational spectra and ring‐puckering potential energy function of 3‐phospholene and 3‐phospholene‐1‐ d 1. 73:5556-5563. 1980
Spectra and structure of small‐ring molecules. XLI. Microwave spectrum of 3‐phospholene. 73:5564-5567. 1980
Erratum: A method to reduce the number of two electron integral transformations in a second order multiconfigurational Hartree–Fock procedure [J. Chem. Phys. 72, 6466 (1980)]. 73:5408-5408. 1980
Isotopic dilution studies of the chloroform–chloroform‐ d system by Raman difference spectroscopy. 73:4971-4975. 1980
The selective preparation of excited vibrational states using the stimulated resonance Raman effect. 73:4798-4806. 1980
A new approach to molecular collisions: Statistical quasiclassical method. 73:2238-2242. 1980
Mode damping in multiconfigurational Hartree–Fock procedures. 73:2811-2816. 1980
A method to reduce the number of two electron integral transformations in a second order multiconfigurational Hartree–Fock procedure. 72:6466-6473. 1980
Direct picosecond observation of unrelaxed fluorescence from tetracene in condensed media. 72:6802-6803. 1980
Determination of frequency shifts by Raman difference spectroscopy. 72:5305-5311. 1980
A b i n i t i o effective valence shell Hamiltonian for the neutral and ionic valence states of N, O, F, Si, P, and S. 72:4158-4173. 1980
Rotation diffusion of aromatic dianions. 72:2841-2848. 1980
Critical test of equation‐of‐motion–Green’s function methods. I. Theory of higher order terms. 72:602-610. 1980
Critical test of equation‐of‐motion–Green’s function methods. II. Comparison with configuration interaction results. 72:611-620. 1980
Radiation damage studies by x‐ray photoelectron spectroscopy. III. Electron irradiated halates and perhalates. 71:4601-4610. 1979
Convergency studies of second and approximate second order multiconfigurational Hartree−Fock procedures. 71:755-760. 1979
Specific heat of bulklike NiO powder from 14 to 280 K. 70:4232-4237. 1979
Picosecond kinetics of copper and silver protoporphyrins. 70:1720-1726. 1979
On the picosecond kinetics and photostability of indigo and 6,6ʹ-dimethoxyindigo. 70:886-892. 1979
Radiation damage studies by x‐ray photoelectron spectroscopy. II. Electron irradiated Li 2 CrO 4 and Li 2 WO 4. 69:4374-4380. 1978
Correlated wavefunctions for the water molecule. 68:5292-5294. 1978
Dependence of radiationless relaxation in acridine on solvent using picosecond spectroscopy. 68:4435-4438. 1978
Low‐frequency vibrational spectra and conformations of bicyclo [3.2.0] hept‐6‐ene and 2‐oxabicyclo [3.2.0] hept‐6‐ene. 68:3298-3307. 1978
Fluorine peroxide (FOOF): A problem molecule for theoretical structural predictions. 68:2507-2508. 1978
Radiation damage studies by x-ray photoelectron spectroscopy. I. Electron irradiated LiNO3 and Li2SO4. 68:2718-2724. 1978
Erratum: Electronic relaxation of acridin as studied by picosecond spectroscopy. 68:344-344. 1978
Formulation of the direct configuration interaction method for triplet spin states. Applications to glyoxal. 68:769-774. 1978
Symmetry restricted multiconfiguration annihilation of single excitations. II. Applications: Electronic states of methylnitrene. 68:2696-2701. 1978
MOLECULAR-STRUCTURE OF METHYL ANION CH-3(-) - INVESTIGATION OF EFFECTS OF ELECTRON CORRELATION USING THEORY OF SELF-CONSISTENT ELECTRON PAIRS (SCEP). 67:4071-4075. 1977
Energy separation between the open ( C 2 v ) and closed ( D 3 h ) forms of ozone. 67:848-849. 1977
Electronic relaxation of acridine as studied by picosecond spectroscopy. 66:4287-4293. 1977
Comparison of final state approximations in the calculation of total and differential photoemission cross sections of neon. 66:2378-2386. 1977
Theoretical studies of atmospheric triatomic molecules: A b i n i t i o equations of motion excitation energies for valence states of the configuration 1π 3 g 2π 1 u in CO 2. 66:2344-2346. 1977
Electron correlation effects on the excitation energies of the lowest triplet states of glyoxal. 67:2422-2427. 1977
Transition moments between excited electronic states of N2. 67:2473-2477. 1977
Picosecond dynamics of electron localization in metal/methyl amine solutions. 64:191-196. 1976
Structural phase transitions in solids with applied stresses and fields, and effect of isotopic impurities on the free energy. 64:552-553. 1976
An equations of motion approach for open shell systems. 63:4861-4869. 1975
Reply to Comment by A. Laubereau on ’’Intermolecular energy transfer in liquid benzene: Raman spectra, linewidth measurements, picosecond spectroscopy, and vibrational relaxation times’’. 63:2262-2263. 1975
Weak exchange in the Heisenberg linear chain: Structure and EPR of [N( n ‐Bu) 4 ] 2 [Cu(mnt) 2 ]. 63:1926-1942. 1975
Subpicosecond relaxation of localized electrons in liquid ammonia. 63:1205-1210. 1975
Simple model for surface specific heats. 63:991-995. 1975
Raman spectra and ring puckering of silacyclobutane‐ d 0 and ‐1,1‐ d 2 and silacyclopent‐3‐ene. 62:1932-1935. 1975
Low-frequency vibrational spectra and ring puckering of cyclopentene-d8. 63:3727-3730. 1975
Raman spectra and internal rotation of methylcyclopropane and its analogs. 62:303-304. 1975
Model for H + 2 ( v = 0)–He collisions above 2 eV. 61:5060-5065. 1974
Raman spectra and out‐of‐plane ring vibrations of bicyclo [3.1.0] hexane and its analogs. 61:2342-2345. 1974
Assignments in the electronic spectrum of water. 61:755-758. 1974
Intermolecular energy transfer in liquid benzene: Raman spectra, linewidth measurements, picosecond spectroscopy, and vibrational relaxation times. 60:3824-3830. 1974
Equations of motion method: Excitation energies and intensities in formaldehyde. 60:2714-2716. 1974
Spin and bonding properties and optical spectra of octahedral transition metal complexes using the multiple scattering X α method. 60:1514-1521. 1974
Erratum: Surface thermodynamic functions for NaCl. 59:6691-6691. 1973
Solvent reorganization around a "giant dipole" molecule. 59:5020-5041. 1973
Infrared intensity measurements of the Pt‐H stretching vibration in Pt(II) complexes and their relationship to similar measurements for hydrogen chemisorbed on platinum. 59:3869-3870. 1973
Dynamics of solvation of an excess electron. 59:766-773. 1973
Time resolution and characteristics of a broadband picosecond continuum and light gate. 58:5237-5246. 1973
Properties of liquid neon derived from sound velocity measurements. 56:5730-5731. 1972
Faddeev Approach to the Collinear Three Body Problem with Numerical Results. 57:4415-4424. 1972
Laser Excited Emission Spectroscopy of Azulene in the Gas Phase. 56:4826-4833. 1972
Triplet Exciton EPR and Crystal Structure of [TMPD + ] 2 [Ni(mnt) 2 ] −2. 56:3490-3502. 1972
Uses of Self‐Focusing and Dispersion Effects in Time‐Resolved Picosecond Spectroscopy. 56:1066-1072. 1972
Energy Decay Characteristics of Benzophenone. 56:361-370. 1972
Surface Thermodynamic Functions for NaCl. 55:3121-3126. 1971
Isotopic Shift for Vibrations with Potential Energy Barriers. 55:2514-2516. 1971
Thermodynamic Functions and Debye–Waller Factor for Adsorbed Particles. 54:2605-2611. 1971
Ultrasonic Velocity and Attenuation in Liquid Neon. 54:2429-2436. 1971
Far-Infrared Spectrum and Ring-Puckering Potential of Silacyclopent-2-ene. 52:352-357. 1970
Kinetics of an Infrared Stimulable Phosphor. 52:6443-6444. 1970
Reply to “Comment on `Two‐Channel Model for Electron Transfer in Ion‐Molecule Collisions' ”. 52:6452-6453. 1970
ESR of TMPD–TCNQ: Spin Excitations of the Heisenberg Regular Linear Chain. 52:4011-4023. 1970
Far‐Infrared Spectrum and Ring‐Puckering Potential of Silacyclopent‐2‐ene. 52:358-360. 1970
Far-infrared spectra and the ring-puckering potential function of silacyclopent-3-ene and silacyclopent-3-ene-1,l-d2. 50:600-609. 1969
Surface Thermodynamic Functions for Noble‐Gas Crystals. 51:4820-4829. 1969
Two‐Channel Model for Electron Transfer in Ion–Molecule Collisions. 51:4236-4237. 1969
Electron Spin Resonance of the Thermally Excited Quintet State of an Oxo‐Bridged Binuclear Iron(III) Complex. 51:3128-3129. 1969
Far‐Infrared Spectrum and the Barrier to Pseudorotation of Silacyclopentane. 50:1946-1951. 1969
Structure of Nitric Oxide Adsorbed on 4A Molecular Sieve. 50:2598-2603. 1969
Far‐Infrared Spectra and the Ring‐Puckering Potential Function of Silacyclopent‐3‐ene and Silacyclopent‐3‐ene‐1,1‐d 2. 50:776-782. 1969
Far‐Infrared Spectra of Ring Compounds. III. Spectrum, Structure, and Ring‐Puckering Potential of Silacyclobutane. 48:1508-1513. 1968
Far‐Infrared Spectra of Ring Compounds. II. The Spectrum and Ring‐Puckering Potential Function of Cyclopentene. 47:4941-4945. 1967
Volume Viscosity in Liquid Argon at High Pressures. 45:4669-4676. 1966
Generation of Sound Waves in Liquids Accompanying Two‐Photon Absorption. 44:2931-2934. 1966
Excess Ultrasonic Attenuation and Intrinsic‐Volume Viscosity in Liquid Argon. 44:741-744. 1966
Multiphoton Absorption and Optical‐Harmonic Generation in Highly Absorbing Molecular Crystals. 43:1281-1286. 1965
Ultrasonic Attenuation in Liquid Argon. 42:3725-3725. 1965
Raman spectra and ring puckering of silacyclobutane-d0 and -1,1-d2 and silacyclopent-3-ene 1975

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