| 1 | Imaging the Photochemistry of the Hydrogen-Bonded Heptazine–Water Complex with Femtosecond Time-Resolved Spectroscopy: A Computational Study | 2.7 | 0 | Citations (PDF) |
| 2 | Reduction of CO<sub>2</sub> with Hydrated Electrons: Ab Initio Computational Studies for Finite-Size Cluster Models | 2.7 | 1 | Citations (PDF) |
| 3 | Tuning UV Pump X-ray Probe Spectroscopy on the Nitrogen K Edge Reveals the Radiationless Relaxation of Pyrazine: <i>Ab Initio</i> Simulations Using the Quasiclassical Doorway–Window Approximation | 4.6 | 8 | Citations (PDF) |
| 4 | Excited-state singlet–triplet inversion in hexagonal aromatic and heteroaromatic compounds | 2.8 | 8 | Citations (PDF) |
| 5 | Local Hydrogen Bonding Determines Branching Pathways in Intermolecular Heptazine Photochemistry | 2.9 | 6 | Citations (PDF) |
| 6 | Water Oxidation and Hydrogen Evolution with Organic Photooxidants: A Theoretical Perspective | 2.9 | 4 | Citations (PDF) |
| 7 | Ab Initio Electronic Structure Study of the Photoinduced Reduction of Carbon Dioxide with the Heptazinyl Radical | 2.7 | 4 | Citations (PDF) |
| 8 | On the propensity of formation of cyclobutane dimers in face-to-face and face-to-back uracil stacks in solution | 2.8 | 2 | Citations (PDF) |
| 9 | <i>Ab initio</i> trajectory surface-hopping dynamics studies of excited-state proton-coupled electron transfer reactions in trianisoleheptazine–phenol complexes | 2.8 | 5 | Citations (PDF) |
| 10 | Equation-of-Motion Methods for the Calculation of Femtosecond Time-Resolved 4-Wave-Mixing and <i>N</i>-Wave-Mixing Signals | 54.6 | 31 | Citations (PDF) |
| 11 | Triangular boron carbon nitrides: an unexplored family of chromophores with unique properties for photocatalysis and optoelectronics | 2.8 | 38 | Citations (PDF) |
| 12 | Simulation of UV absorption spectra and relaxation dynamics of uracil and uracil–water clusters | 2.8 | 19 | Citations (PDF) |
| 13 | Strong static and dynamic Jahn–Teller and pseudo-Jahn–Teller effects in niobium tetrafluoride | 3.0 | 3 | Citations (PDF) |
| 14 | Ab Initio Surface-Hopping Simulation of Femtosecond Transient-Absorption Pump–Probe Signals of Nonadiabatic Excited-State Dynamics Using the Doorway–Window Representation | 5.5 | 29 | Citations (PDF) |
| 15 | Can Hydrated Electrons be Produced from Water with Visible Light? | 2.7 | 7 | Citations (PDF) |
| 16 | Are Heptazine-Based Organic Light-Emitting Diode Chromophores Thermally Activated Delayed Fluorescence or Inverted Singlet–Triplet Systems? | 4.6 | 60 | Citations (PDF) |
| 17 | Combined Surface-Hopping, Dyson Orbital, and B-Spline Approach for the Computation of Time-Resolved Photoelectron Spectroscopy Signals: The Internal Conversion in Pyrazine | 5.5 | 20 | Citations (PDF) |
| 18 | Quantum dynamics with ab initio potentials | 3.0 | 2 | Citations (PDF) |
| 19 | Ab Initio Nonadiabatic Surface-Hopping Trajectory Simulations of Photocatalytic Water Oxidation and Hydrogen Evolution with the Heptazine Chromophore | 2.7 | 14 | Citations (PDF) |
| 20 | Ab Initio Quasiclassical Simulation of Femtosecond Time-Resolved Two-Dimensional Electronic Spectra of Pyrazine | 4.6 | 17 | Citations (PDF) |
| 21 | Multi-faceted spectroscopic mapping of ultrafast nonadiabatic dynamics near conical intersections: A computational study | 3.0 | 32 | Citations (PDF) |
| 22 | Photooxidation of water with heptazine-based molecular photocatalysts: Insights from spectroscopy and computational chemistry | 3.0 | 21 | Citations (PDF) |
| 23 | Photoinduced water oxidation in pyrimidine–water clusters: a combined experimental and theoretical study | 2.8 | 16 | Citations (PDF) |
| 24 | First-principles study of large-amplitude dynamic Jahn–Teller effects in vanadium tetrafluoride | 3.0 | 5 | Citations (PDF) |
| 25 | Control of Excited-State Proton-Coupled Electron Transfer by Ultrafast Pump-Push-Probe Spectroscopy in Heptazine-Phenol Complexes: Implications for Photochemical Water Oxidation | 3.2 | 22 | Citations (PDF) |
| 26 | Molecular Design of Heptazine-Based Photocatalysts: Effect of Substituents on Photocatalytic Efficiency and Photostability | 2.7 | 25 | Citations (PDF) |
| 27 | Effects of high pulse intensity and chirp in two-dimensional electronic spectroscopy of an atomic vapor | 3.3 | 15 | Citations (PDF) |
| 28 | Orientational relaxation of a quantum linear rotor in a dissipative environment: Simulations with the hierarchical equations-of-motion method | 3.0 | 5 | Citations (PDF) |
| 29 | Spin-orbit vibronic coupling in Π4 states of linear triatomic molecules | 3.0 | 1 | Citations (PDF) |
| 30 | Singlet–Triplet Inversion in Heptazine and in Polymeric Carbon Nitrides | 2.7 | 120 | Citations (PDF) |
| 31 | Mapping of Wave Packet Dynamics at Conical Intersections by Time- and Frequency-Resolved Fluorescence Spectroscopy: A Computational Study | 4.6 | 25 | Citations (PDF) |
| 32 | Mechanisms of photoreactivity in hydrogen-bonded adenine–H<sub>2</sub>O complexes | 2.8 | 9 | Citations (PDF) |
| 33 | Photoinduced electron-driven proton transfer from water to an N-heterocyclic chromophore: nonadiabatic dynamics studies for pyridine–water clusters | 2.8 | 29 | Citations (PDF) |
| 34 | Beyond artificial photosynthesis: general discussion | 2.7 | 2 | Citations (PDF) |
| 35 | Synthetic approaches to artificial photosynthesis: general discussion | 2.7 | 5 | Citations (PDF) |
| 36 | Analysis of transient-absorption pump-probe signals of nonadiabatic dissipative systems: “Ideal” and “real” spectra | 3.0 | 21 | Citations (PDF) |
| 37 | Origin of Unexpectedly Simple Oscillatory Responses in the Excited-State Dynamics of Disordered Molecular Aggregates | 4.6 | 22 | Citations (PDF) |
| 38 | Assessing the performance of trajectory surface hopping methods: Ultrafast internal conversion in pyrazine | 3.0 | 55 | Citations (PDF) |
| 39 | Role of the Pyridinyl Radical in the Light-Driven Reduction of Carbon Dioxide: A First-Principles Study | 2.7 | 4 | Citations (PDF) |
| 40 | Monitoring of Nonadiabatic Effects in Individual Chromophores by Femtosecond Double-Pump Single-Molecule Spectroscopy: A Model Study | 4.4 | 6 | Citations (PDF) |
| 41 | UV absorption spectra of DNA bases in the 350–190 nm range: assignment and state specific analysis of solvation effects | 2.8 | 15 | Citations (PDF) |
| 42 | Barrierless Heptazine-Driven Excited State Proton-Coupled Electron Transfer: Implications for Controlling Photochemistry of Carbon Nitrides and Aza-Arenes | 3.2 | 24 | Citations (PDF) |
| 43 | Multimode quantum dynamics with multiple Davydov D2 trial states: Application to a 24-dimensional conical intersection model | 3.0 | 34 | Citations (PDF) |
| 44 | Solar Energy Harvesting with Carbon Nitrides and N‐Heterocyclic Frameworks: Do We Understand the Mechanism? | 2.7 | 31 | Citations (PDF) |
| 45 | Proton-Coupled Electron Transfer from Water to a Model Heptazine-Based Molecular Photocatalyst | 4.6 | 59 | Citations (PDF) |
| 46 | Photoinduced hydrogen-transfer reactions in pyridine-water clusters: Insights from excited-state electronic-structure calculations | 2.2 | 10 | Citations (PDF) |
| 47 | Enhanced S<sub>2</sub> Fluorescence from a Free-Base Tetraphenylporphyrin Surface-Mounted Metal Organic Framework | 3.2 | 15 | Citations (PDF) |
| 48 | Simulation of Femtosecond Phase-Locked Double-Pump Signals of Individual Light-Harvesting Complexes LH2 | 4.6 | 9 | Citations (PDF) |
| 49 | Mechanism of Photocatalytic Water Oxidation by Graphitic Carbon Nitride | 4.6 | 26 | Citations (PDF) |
| 50 | Mechanism of photocatalytic water splitting with triazine-based carbon nitrides: insights from <i>ab initio</i> calculations for the triazine–water complex | 2.8 | 33 | Citations (PDF) |
| 51 | Resonant femtosecond stimulated Raman spectroscopy with an intense actinic pump pulse: Application to conical intersections | 3.0 | 7 | Citations (PDF) |
| 52 | Mechanism of Photocatalytic Water Splitting with Graphitic Carbon Nitride: Photochemistry of the Heptazine–Water Complex | 2.7 | 90 | Citations (PDF) |
| 53 | Photodissociation dynamics of the pyridinyl radical: Time-dependent quantum wave-packet calculations | 3.0 | 20 | Citations (PDF) |
| 54 | Efficient orientational averaging of nonlinear optical signals in multi-chromophore systems | 3.0 | 15 | Citations (PDF) |
| 55 | Accuracy of trajectory surface-hopping methods: Test for a two-dimensional model of the photodissociation of phenol | 3.0 | 47 | Citations (PDF) |
| 56 | Theoretical aspects of femtosecond double-pump single-molecule spectroscopy. II. Strong-field regime | 2.8 | 14 | Citations (PDF) |
| 57 | Theoretical aspects of femtosecond double-pump single-molecule spectroscopy. I. Weak-field regime | 2.8 | 14 | Citations (PDF) |
| 58 | Nonperturbative response functions: A tool for the interpretation of four-wave-mixing signals beyond third order | 3.0 | 13 | Citations (PDF) |
| 59 | Role of Electron-Driven Proton-Transfer Processes in the Ultrafast Deactivation of Photoexcited Anionic 8-oxoGuanine-Adenine and 8-oxoGuanine-Cytosine Base Pairs | 4.4 | 11 | Citations (PDF) |
| 60 | Structural dynamics: general discussion | 2.7 | 0 | Citations (PDF) |
| 61 | Vibrational and condensed phase dynamics: general discussion | 2.7 | 1 | Citations (PDF) |
| 62 | Attosecond processes and X-ray spectroscopy: general discussion | 2.7 | 0 | Citations (PDF) |
| 63 | Electronic and non-adiabatic dynamics: general discussion | 2.7 | 3 | Citations (PDF) |
| 64 | State-specific tunneling lifetimes from classical trajectories: H-atom dissociation in electronically excited pyrrole | 3.0 | 12 | Citations (PDF) |
| 65 | Relativistic theory of the Jahn-Teller effect: <i>p</i>-orbitals in tetrahedral and trigonal systems | 3.0 | 17 | Citations (PDF) |
| 66 | Femtosecond stimulated Raman spectroscopy as a tool to detect molecular vibrations in ground and excited electronic states | 3.0 | 4 | Citations (PDF) |
| 67 | Alternative view of two-dimensional spectroscopy | 3.0 | 13 | Citations (PDF) |
| 68 | Onset of the Electronic Absorption Spectra of Isolated and π-Stacked Oligomers of 5,6-Dihydroxyindole: An <i>Ab Initio</i> Study of the Building Blocks of Eumelanin | 2.9 | 39 | Citations (PDF) |
| 69 | Dissipative dynamics at conical intersections: simulations with the hierarchy equations of motion method | 2.7 | 44 | Citations (PDF) |
| 70 | Conical-Intersection Topographies Suggest That Ribose Exhibits Enhanced UV Photostability | 2.9 | 13 | Citations (PDF) |
| 71 | Excited‐State Deactivation of Adenine by Electron‐Driven Proton‐Transfer Reactions in Adenine–Water Clusters: A Computational Study | 2.0 | 19 | Citations (PDF) |
| 72 | Resonant Femtosecond Stimulated Raman Spectra: Theory and Simulations | 2.7 | 16 | Citations (PDF) |
| 73 | A ‘bottom up’, ab initio computational approach to understanding fundamental photophysical processes in nitrogen containing heterocycles, DNA bases and base pairs | 2.8 | 83 | Citations (PDF) |
| 74 | Photocatalytic water splitting with acridine dyes: Guidelines from computational chemistry | 2.2 | 10 | Citations (PDF) |
| 75 | Excited-state deactivation in 8-oxo-deoxyguanosine: comparison between anionic and neutral forms | 2.8 | 15 | Citations (PDF) |
| 76 | Microscopic derivation of the Keilson–Storer master equation | 2.2 | 4 | Citations (PDF) |
| 77 | Quantum dynamics on a three-sheeted six-dimensional <i>ab initio</i> potential-energy surface of the phosphine cation: Simulation of the photoelectron spectrum and the ultrafast radiationless decay dynamics | 3.0 | 8 | Citations (PDF) |
| 78 | <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si3.gif" overflow="scroll"><mml:mrow><mml:mi>E</mml:mi><mml:mo>×</mml:mo><mml:mi>e</mml:mi></mml:mrow></mml:math> Jahn–Teller effect in the <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si1.gif" overflow="scroll"><mml:mrow><mml:msubsup><mml:mrow><mml:mtext>P</mml:mtext></mml:mrow><mml:mrow><mml:mn>4</mml:mn></mml:mrow><mml:mrow><mml:mo>+</mml:mo></mml:mrow></mml:msubsup></mml:mrow></mml:math> cation and its signatures in the | 2.2 | 4 | Citations (PDF) |
| 79 | Theory of femtosecond coherent double-pump single-molecule spectroscopy: Application to light harvesting complexes | 3.0 | 25 | Citations (PDF) |
| 80 | Nonadiabatic nuclear dynamics of the ammonia cation studied by surface hopping classical trajectory calculations | 3.0 | 49 | Citations (PDF) |
| 81 | Simulation of femtosecond two-dimensional electronic spectra of conical intersections | 3.0 | 32 | Citations (PDF) |
| 82 | Photocatalytic Water Splitting with the Acridine Chromophore: A Computational Study | 2.9 | 41 | Citations (PDF) |
| 83 | Photoinduced water splitting via benzoquinone and semiquinone sensitisation | 2.8 | 30 | Citations (PDF) |
| 84 | Quasi-classical nonadiabatic transition probability for G3/2×(t2+e) Jahn–Teller systems | 2.2 | 2 | Citations (PDF) |
| 85 | Mechanisms of Photostability in Kynurenines: A Joint Electronic-Structure and Dynamics Study | 2.9 | 32 | Citations (PDF) |
| 86 | Signatures of conical intersections in two-dimensional electronic spectra | 1.8 | 35 | Citations (PDF) |
| 87 | Electronically excited states and photochemical reaction mechanisms of β-glucose | 2.8 | 20 | Citations (PDF) |
| 88 | Infrared Absorption Spectra of Jahn–Teller Systems: Application to the Transition-Metal Trifluorides MnF<sub>3</sub> and NiF<sub>3</sub> | 2.7 | 8 | Citations (PDF) |
| 89 | Mechanisms of Ultrafast Excited-State Deactivation in Adenosine | 2.7 | 83 | Citations (PDF) |
| 90 | The (<i>E</i> + <i>A</i>) × (<i>e</i> + <i>a</i>) Jahn–Teller and Pseudo-Jahn–Teller Hamiltonian Including Spin–Orbit Coupling for Trigonal Systems | 2.7 | 25 | Citations (PDF) |
| 91 | Photochemical Mechanisms of Radiationless Deactivation Processes in Urocanic Acid | 2.9 | 38 | Citations (PDF) |
| 92 | Photoinduced Oxidation of Water in the Pyridine–Water Complex: Comparison of the Singlet and Triplet Photochemistries | 2.7 | 33 | Citations (PDF) |
| 93 | <i>Ab Initio</i> Study of Potential Ultrafast Internal Conversion Routes in Oxybenzone, Caffeic Acid, and Ferulic Acid: Implications for Sunscreens | 2.7 | 89 | Citations (PDF) |
| 94 | Photochemistry of 2-Aminooxazole, a Hypothetical Prebiotic Precursor of RNA Nucleotides | 4.6 | 30 | Citations (PDF) |
| 95 | Interpolation of multi-sheeted multi-dimensional potential-energy surfaces via a linear optimization procedure | 3.0 | 27 | Citations (PDF) |
| 96 | Ab initio study of the cyclodimerization of uracil through butane-like and oxetane-like conical intersections | 4.3 | 5 | Citations (PDF) |
| 97 | Strong-pump strong-probe spectroscopy: effects of higher excited electronic states | 2.8 | 23 | Citations (PDF) |
| 98 | A multi-sheeted three-dimensional potential-energy surface for the H-atom photodissociation of phenol | 2.7 | 33 | Citations (PDF) |
| 99 | Computational investigation of the photoinduced homolytic dissociation of water in the pyridine–water complex | 2.8 | 52 | Citations (PDF) |
| 100 | Calculation of third-order signals via driven Schrödinger equations: General results and application to electronic 2D photon echo spectroscopy | 2.2 | 25 | Citations (PDF) |
| 101 | Pump-probe spectroscopy with strong pulses as a tool to enhance weak electronic transitions | 2.7 | 11 | Citations (PDF) |
| 102 | Spectroscopy meets theory | 13.9 | 29 | Citations (PDF) |
| 103 | Jahn-Teller theory beyond the standard model | 0.4 | 13 | Citations (PDF) |
| 104 | Simple Recipes for Separating Excited-State Absorption and Cascading Signals by Polarization-Sensitive Measurements | 2.7 | 12 | Citations (PDF) |
| 105 | Domain of validity of the perturbative approach to femtosecond optical spectroscopy | 3.0 | 14 | Citations (PDF) |
| 106 | Ultrafast non-adiabatic dynamics of ethylene including Rydberg states | 2.4 | 43 | Citations (PDF) |
| 107 | Quantum dynamics of electron-transfer reactions: photoinduced intermolecular electron transfer in a porphyrin–quinone complex | 2.4 | 25 | Citations (PDF) |
| 108 | Bath-induced correlations and relaxation of vibronic dimers | 3.0 | 22 | Citations (PDF) |
| 109 | Nonadiabatic Nuclear Dynamics in the Ammonia Cation Studied by the Branching Classical Trajectory Method | 0.4 | 0 | Citations (PDF) |
| 110 | On the nature and signatures of the solvated electron in water | 2.8 | 141 | Citations (PDF) |
| 111 | Relativistic Jahn–Teller and pseudo-Jahn–Teller couplings in systems | 2.2 | 18 | Citations (PDF) |
| 112 | Jahn-Teller, pseudo-Jahn-Teller, and spin-orbit coupling Hamiltonian of a <i>d</i> electron in an octahedral environment | 3.0 | 38 | Citations (PDF) |
| 113 | Photoinduced water splitting with oxotitanium porphyrin: a computational study | 2.8 | 26 | Citations (PDF) |
| 114 | <i>Ab initio</i> study of dynamical <i>E</i> × <i>e</i> Jahn-Teller and spin-orbit coupling effects in the transition-metal trifluorides TiF3, CrF3, and NiF3 | 3.0 | 34 | Citations (PDF) |
| 115 | Role of Conical Intersections in Molecular Spectroscopy and Photoinduced Chemical Dynamics | 11.6 | 428 | Citations (PDF) |
| 116 | Optical <i>N</i>-Wave-Mixing Spectroscopy with Strong and Temporally Well-Separated Pulses: The Doorway−Window Representation | 2.9 | 21 | Citations (PDF) |
| 117 | Strong and Long Makes Short: Strong-Pump Strong-Probe Spectroscopy | 4.6 | 22 | Citations (PDF) |
| 118 | Efficient Excited-State Deactivation in Organic Chromophores and Biologically Relevant Molecules: Role of Electron and Proton Transfer Processes | 13.0 | 4 | Citations (PDF) |
| 119 | Spin-Orbit Vibronic Coupling in Jahn–Teller Systems | 13.0 | 8 | Citations (PDF) |
| 120 | Exact quantum master equation for a molecular aggregate coupled to a harmonic bath | 2.1 | 20 | Citations (PDF) |
| 121 | Relativistic Jahn-Teller effects in the photoelectron spectra of tetrahedral P4, As4, Sb4, and Bi4 | 3.0 | 18 | Citations (PDF) |
| 122 | Molecular mechanisms of the photostability of indigo | 2.8 | 90 | Citations (PDF) |
| 123 | Efficient Methods for Computation of Ultrafast Time‐ and Frequency‐Resolved Spectroscopic Signals 2011, , 445-473 | | 1 | Citations (PDF) |
| 124 | Jahn–Teller and spin–orbit coupling effects in transition-metal trifluorides | 2.2 | 43 | Citations (PDF) |
| 125 | Effect of the Chirality of Residues and γ‐Turns on the Electronic Excitation Spectra, Excited‐State Reaction Paths and Conical Intersections of Capped Phenylalanine–Alanine Dipeptides | 2.0 | 12 | Citations (PDF) |
| 126 | Conical Intersections | 13.0 | 320 | Citations (PDF) |
| 127 | First-principles study of photoinduced electron-transfer dynamics in a Mg–porphyrin–quinone complex | 2.8 | 22 | Citations (PDF) |
| 128 | Relativistic T×T and T×E Jahn–Teller coupling in tetrahedral systems | 2.2 | 27 | Citations (PDF) |
| 129 | High-order expansion of <mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si5.gif" display="inline" overflow="scroll"><mml:mrow><mml:msub><mml:mrow><mml:mi>T</mml:mi></mml:mrow><mml:mrow><mml:mn>2</mml:mn></mml:mrow></mml:msub><mml:mo>×</mml:mo><mml:mi>e</mml:mi></mml:mrow></mml:math> Jahn–Teller potential-energy surfaces in tetrahedral systems | 2.8 | 30 | Citations (PDF) |
| 130 | Photoinduced Proton Transfer as a Possible Mechanism for Highly Efficient Excited-State Deactivation in Proteins | 4.6 | 22 | Citations (PDF) |
| 131 | High-order expansion of T2×t2 Jahn–Teller potential-energy surfaces in tetrahedral molecules | 3.0 | 58 | Citations (PDF) |
| 132 | Relativistic Jahn-Teller effect in tetrahedral systems | 2.7 | 32 | Citations (PDF) |
| 133 | Comparison of the non-radiative decay mechanisms of 4-pyrimidinone and uracil: an ab initio study | 2.8 | 60 | Citations (PDF) |
| 134 | Role of excited-state hydrogen detachment and hydrogen-transfer processes for the excited-state deactivation of an aromatic dipeptide: N-acetyl tryptophan methyl amide | 2.8 | 29 | Citations (PDF) |
| 135 | Efficient calculation of the polarization induced by N coherent laser pulses | 3.0 | 21 | Citations (PDF) |
| 136 | Manipulating electronic couplings and nonadiabatic nuclear dynamics with strong laser pulses | 3.0 | 27 | Citations (PDF) |
| 137 | Ab initio study of the energetics of photoinduced electron and proton transfer processes in a bio-inspired model of photochemical water splitting | 2.8 | 11 | Citations (PDF) |
| 138 | Photophysics of the Trp-Gly dipeptide: Role of electron and proton transfer processes for efficient excited-state deactivation | 2.8 | 26 | Citations (PDF) |
| 139 | Efficient Excited-State Deactivation of the Gly-Phe-Ala Tripeptide via an Electron-Driven Proton-Transfer Process | 15.7 | 63 | Citations (PDF) |
| 140 | Efficient Calculation of Time- and Frequency-Resolved Four-Wave-Mixing Signals | 17.7 | 88 | Citations (PDF) |
| 141 | Computational Studies of the Photophysics of Neutral and Zwitterionic Amino Acids in an Aqueous Environment: Tyrosine−(H2O)2 and Tryptophan−(H2O)2 Clusters | 2.7 | 57 | Citations (PDF) |
| 142 | Photophysics of xanthine: computational study of the radiationless decay mechanisms | 2.8 | 32 | Citations (PDF) |
| 143 | Role of vibrational energy relaxation in the photoinduced nonadiabatic dynamics of pyrrole at the conical intersection | 2.2 | 27 | Citations (PDF) |
| 144 | Computational studies of the photophysics of neutral and zwitterionic glycine in an aqueous environment: The glycine–(H2O)2 cluster | 2.8 | 9 | Citations (PDF) |
| 145 | The 3E×E, 4E×E and 5E×E Jahn–Teller Hamiltonians of trigonal systems | 2.2 | 18 | Citations (PDF) |
| 146 | Renner-Teller and spin-orbit vibronic coupling effects in linear triatomic molecules with a half-filled π shell | 3.0 | 9 | Citations (PDF) |
| 147 | Vibronic Effects in Single Molecule Conductance: First-Principles Description and Application to Benzenealkanethiolates between Gold Electrodes | 3.2 | 59 | Citations (PDF) |
| 148 | Computational Model of Photocatalytic Water Splitting | 2.7 | 17 | Citations (PDF) |
| 149 | Ab Initio Studies on the Photophysics of Guanine Tautomers: Out-of-Plane Deformation and NH Dissociation Pathways to Conical Intersections | 2.7 | 48 | Citations (PDF) |
| 150 | Nonradiative Decay Mechanisms of the Biologically Relevant Tautomer of Guanine | 2.7 | 106 | Citations (PDF) |
| 151 | Photochemistry of hydrogen-bonded aromatic pairs: Quantum dynamical calculations for the pyrrole–pyridine complex | 7.7 | 73 | Citations (PDF) |
| 152 | <i>Ab initio</i> characterization of the conical intersections involved in the photochemistry of phenol | 3.0 | 107 | Citations (PDF) |
| 153 | Effects of intense femtosecond pumping on ultrafast electronic-vibrational dynamics in molecular systems with relaxation | 3.0 | 46 | Citations (PDF) |
| 154 | Relativistic E×T Jahn–Teller effect in tetrahedral systems | 3.0 | 32 | Citations (PDF) |
| 155 | Quasiclassical theory of the dynamicalE × EJahn–Teller effect including spin–orbit interaction | 2.4 | 9 | Citations (PDF) |
| 156 | Spin-orbit vibronic coupling in Π3 states of linear triatomic molecules | 3.0 | 22 | Citations (PDF) |
| 157 | Computational Studies of the Photophysics of Hydrogen-Bonded Molecular Systems | 2.7 | 224 | Citations (PDF) |
| 158 | Conical intersections involving the dissociative1πσ* state in 9H-adenine: a quantum chemical ab initio study | 2.8 | 57 | Citations (PDF) |
| 159 | Theory of Ultrafast Nonadiabatic Excited-State Processes and their Spectroscopic Detection in Real Time | 0.0 | 187 | Citations (PDF) |
| 160 | Computational studies of aqueous-phase photochemistry and the hydrated electron in finite-size clusters | 2.8 | 45 | Citations (PDF) |
| 161 | Photoinduced Electron and Proton Transfer in the Hydrogen-Bonded Pyridine−Pyrrole System | 2.9 | 29 | Citations (PDF) |
| 162 | Photophysics of Eumelanin: Ab Initio Studies on the Electronic Spectroscopy and Photochemistry of 5,6-Dihydroxyindole | 2.0 | 66 | Citations (PDF) |
| 163 | A study of spin–orbit vibronic-coupling effects in the<mml:math xmlns:mml="http://www.w3.org/1998/Math/MathML" altimg="si7.gif" display="inline" overflow="scroll"><mml:mrow><mml:mover accent="true"><mml:mrow><mml:mtext>A</mml:mtext></mml:mrow><mml:mrow><mml:mo stretchy="true">∼</mml:mo></mml:mrow></mml:mover><mml:msup><mml:mrow /><mml:mrow><mml:mn>3</mml:mn></mml:mrow></mml:msup><mml:mi mathvariant="normal">Π</mml:mi></mml:mrow></mml:math>state of CCX (X = O, S, Se) and CNY (Y = N, P, As) | 2.8 | 9 | Citations (PDF) |
| 164 | Quasistationary upper-well states of E×E Jahn–Teller systems with spin-orbit coupling | 2.2 | 8 | Citations (PDF) |
| 165 | Analysis of vibrational coherences in homodyne and two-dimensional heterodyne photon-echo spectra of Nile Blue | 2.2 | 22 | Citations (PDF) |
| 166 | Photoinduced multi-mode quantum dynamics of pyrrole at the – conical intersections | 4.3 | 44 | Citations (PDF) |
| 167 | Multimode Molecular Dynamics Beyond the Born-Oppenheimer Approximation | 0.0 | 740 | Citations (PDF) |
| 168 | Resonance Raman Spectrum of the Solvated Electron in Methanol: Simulation within a Cluster Model | 2.7 | 6 | Citations (PDF) |
| 169 | Conical Intersections in Thymine | 2.7 | 206 | Citations (PDF) |
| 170 | Geometric phase effects in the coherent control of the branching ratio of photodissociation products of phenol | 3.0 | 73 | Citations (PDF) |
| 171 | Photophysics of Organic Photostabilizers. Ab Initio Study of the Excited-State Deactivation Mechanisms of 2-(2‘-Hydroxyphenyl)benzotriazole | 2.7 | 106 | Citations (PDF) |
| 172 | Photoionization-induced dynamics of ammonia:Ab initiopotential energy surfaces and time-dependent wave packet calculations for the ammonia cation | 3.0 | 78 | Citations (PDF) |
| 173 | Photophysics of intramolecularly hydrogen-bonded aromatic systems: ab initio exploration of the excited-state deactivation mechanisms of salicylic acid | 2.8 | 132 | Citations (PDF) |
| 174 | Role of Electron-Driven Proton-Transfer Processes in the Excited-State Deactivation of the Adenine−Thymine Base Pair | 2.7 | 175 | Citations (PDF) |
| 175 | The chemical physics of the photostability of life | 0.4 | 90 | Citations (PDF) |
| 176 | Ab initio studies of the photophysics of 2-aminopurine | 2.4 | 45 | Citations (PDF) |
| 177 | The relativistic E×E Jahn–Teller effect revisited | 2.2 | 46 | Citations (PDF) |
| 178 | Simulation of the photodetachment spectrum of the pyrrolide anion | 2.2 | 21 | Citations (PDF) |
| 179 | Vibronic effects on resonant electron conduction through single molecule junctions | 2.8 | 36 | Citations (PDF) |
| 180 | Two-channel semiclassical S-matrix for the E×E Jahn–Teller problem including spin–orbit coupling | 2.2 | 6 | Citations (PDF) |
| 181 | Generalized diatomics-in-molecule method applied to the anion | 2.2 | 12 | Citations (PDF) |
| 182 | Study of strong Σ–Π and spin–orbit vibronic coupling effects in linear triatomic molecules | 2.2 | 13 | Citations (PDF) |
| 183 | Importance of Spin-Orbit Coupling for the Assignment of the Photodetachment Spectra of AuX2− (X=Cl, Br, and I) | 2.0 | 15 | Citations (PDF) |
| 184 | Relevance of Electron-Driven Proton-Transfer Processes for the Photostability of Proteins | 2.0 | 63 | Citations (PDF) |
| 185 | Calculation of the vibronic structure of the photodetachment spectra of CCCl− and CCBr− | 3.0 | 7 | Citations (PDF) |
| 186 | Calculation of the vibronic structure of the X̃Π2 photoelectron spectra of XCN,X=F, Cl, and Br | 3.0 | 19 | Citations (PDF) |
| 187 | A new method for the calculation of two-pulse time- and frequency-resolved spectra | 2.2 | 25 | Citations (PDF) |
| 188 | Photostability of 9H-adenine: mechanisms of the radiationless deactivation of the lowest excited singlet states | 2.2 | 169 | Citations (PDF) |
| 189 | Isotope effects in vibrational excitation and dissociative electron attachment of DCl and DBr | 1.4 | 8 | Citations (PDF) |
| 190 | Charge transport through a flexible molecular junction | 0.4 | 32 | Citations (PDF) |
| 191 | Efficient method for the calculation of time- and frequency-resolved four-wave mixing signals and its application to photon-echo spectroscopy | 3.0 | 82 | Citations (PDF) |
| 192 | Photochemistry of water: The (H2O)5 cluster | 3.0 | 24 | Citations (PDF) |
| 193 | Experimental and Theoretical Evidence for Long-Lived Molecular Hydrogen AnionsH2−andD2− | 7.8 | 42 | Citations (PDF) |
| 194 | Photochemistry of pyrrole: Time-dependent quantum wave-packet description of the dynamics at the π1σ*-S0 conical intersections | 3.0 | 121 | Citations (PDF) |
| 195 | Spectroscopic effects of first-order relativistic vibronic coupling in linear triatomic molecules | 3.0 | 21 | Citations (PDF) |
| 196 | Time- and frequency-resolved fluorescence spectra of nonadiabatic dissipative systems: What photons can tell us | 3.0 | 45 | Citations (PDF) |
| 197 | Tautomeric selectivity of the excited-state lifetime of guanine/cytosine base pairs: The role of electron-driven proton-transfer processes | 7.7 | 285 | Citations (PDF) |
| 198 | Time-dependent quantum wave-packet description of the π1σ* photochemistry of phenol | 3.0 | 181 | Citations (PDF) |
| 199 | Photochemistry of MCl(H2O)4, M = H, Li, Na clusters: finite-size models of the photodetachment of the chloride anion in salt solutions | 2.8 | 23 | Citations (PDF) |
| 200 | Transient Phenomena in Time- and Frequency-Gated Spontaneous Emission | 2.7 | 6 | Citations (PDF) |
| 201 | Optimal control of ultrafastcis-transphotoisomerization of retinal in rhodopsin via a conical intersection | 3.0 | 75 | Citations (PDF) |
| 202 | Ab Initio Studies on the Radiationless Decay Mechanisms of the Lowest Excited Singlet States of 9H-Adenine | 15.7 | 308 | Citations (PDF) |
| 203 | Photoinduced dynamics of ethene in the N, V, and Z valence states: A six-dimensional nonadiabatic quantum dynamics investigation | 3.0 | 61 | Citations (PDF) |
| 204 | THE MULTI-MODE VIBRONIC-COUPLING APPROACH | 13.0 | 90 | Citations (PDF) |
| 205 | GENERIC ASPECTS OF THE DYNAMICS AT CONICAL INTERSECTIONS: INTERNAL CONVERSION, VIBRATIONAL RELAXATION AND PHOTOISOMERIZATION | 13.0 | 8 | Citations (PDF) |
| 206 | Ab initio studies on the photophysics of the guanine–cytosine base pair | 2.8 | 272 | Citations (PDF) |
| 207 | Quantum dynamical simulations of ultrafast photoinduced electron-transfer processes | 4.3 | 23 | Citations (PDF) |
| 208 | Theoretical study of vibrational wave-packet dynamics in electron-transfer systems | 2.2 | 39 | Citations (PDF) |
| 209 | The relativistic Renner–Teller effect revisited | 2.2 | 28 | Citations (PDF) |
| 210 | Time-resolved spontaneous emission beyond the doorway–window approximation | 2.2 | 23 | Citations (PDF) |
| 211 | Coherent vibrational dynamics during ultrafast photoinduced electron-transfer reactions: quantum dynamical simulations within multilevel Redfield theory | 2.8 | 24 | Citations (PDF) |
| 212 | Unified description of sequential and coherent contributions to time-resolved spontaneous emission signals: generalized doorway–window approach | 2.8 | 18 | Citations (PDF) |
| 213 | Time-dependent quantum wave-packet description of the1πσ* photochemistry of pyrrole | 2.7 | 81 | Citations (PDF) |
| 214 | Simulation of the resonance Raman spectrum of the hydrated electron in the hydrated-hydronium cluster model | 2.8 | 19 | Citations (PDF) |
| 215 | Efficient Deactivation of a Model Base Pair via Excited-State Hydrogen Transfer | 38.2 | 330 | Citations (PDF) |
| 216 | Intramolecular Hydrogen Bonding in the S1(ππ*) Excited State of Anthranilic Acid and Salicylic Acid: TDDFT Calculation of Excited-State Geometries and Infrared Spectra | 2.7 | 98 | Citations (PDF) |
| 217 | Multimode Jahn?Teller and pseudo-Jahn?Teller coupling effects in the photoelectron spectrum of CH3F | 2.2 | 3 | Citations (PDF) |
| 218 | Conical Intersections | 13.0 | 931 | Citations (PDF) |
| 219 | FEMTOSECOND TIME-RESOLVED SPECTROSCOPY OF THE DYNAMICS AT CONICAL INTERSECTIONS | 13.0 | 3 | Citations (PDF) |
| 220 | The Sudden-Polarization Effect and its Role in the Ultrafast Photochemistry of Ethene | 15.0 | 34 | Citations (PDF) |
| 221 | Ab initio study of the excited-state coupled electron–proton-transfer process in the 2-aminopyridine dimer | 2.2 | 167 | Citations (PDF) |
| 222 | Quasiclassical quantization of the four-state vibronic problem associated with accidentally degenerate Σ+, Π and Σ− states | 2.2 | 3 | Citations (PDF) |
| 223 | Theoretical investigation of Jahn–Teller and pseudo-Jahn–Teller interactions in the ammonia cation | 3.0 | 31 | Citations (PDF) |
| 224 | Detection of Electronic and Vibrational Coherence Effects in Electron-Transfer Systems by Femtosecond Time-Resolved Fluorescence Spectroscopy: Theoretical Aspects | 2.7 | 36 | Citations (PDF) |
| 225 | Photochemistry of HCl(H2O)4: Cluster Model of the Photodetachment of the Chloride Anion in Water | 2.7 | 38 | Citations (PDF) |
| 226 | Anionic water clusters with large vertical electron binding energies and their electronic spectra: (H2O)11– and (H2O)14– | 2.8 | 29 | Citations (PDF) |
| 227 | Photoinduced dynamics of the valence states of ethene: A six-dimensional potential-energy surface of three electronic states with several conical intersections | 3.0 | 65 | Citations (PDF) |
| 228 | Modeling of ultrafast electron-transfer processes: Validity of multilevel Redfield theory | 3.0 | 144 | Citations (PDF) |
| 229 | Vibrational excitation of hydrogen fluoride by low-energy electrons: theory and experiment | 1.8 | 35 | Citations (PDF) |
| 230 | Multilevel Redfield description of the dissipative dynamics at conical intersections | 3.0 | 119 | Citations (PDF) |
| 231 | Time- and frequency-gated spontaneous emission as a tool for studying vibrational dynamics in the excited state | 2.7 | 36 | Citations (PDF) |
| 232 | Ab Initio Investigation of the Structure and Spectroscopy of Hydronium−Water Clusters | 2.7 | 156 | Citations (PDF) |
| 233 | Excited-state hydrogen detachment and hydrogen transfer driven by repulsive 1πσ* states: A new paradigm for nonradiative decay in aromatic biomolecules | 2.8 | 882 | Citations (PDF) |
| 234 | Hydrated hydronium: a cluster model of the solvated electron? | 2.8 | 128 | Citations (PDF) |
| 235 | Four-channel semiclassical S-matrix for a Σ+–Π–Σ−-type conical intersection in triatomic systems | 2.2 | 6 | Citations (PDF) |
| 236 | Development of an effective single-electron model of the electronic structure of hydronium and hydronium–water clusters | 2.8 | 13 | Citations (PDF) |
| 237 | Title is missing! | 0.4 | 18 | Citations (PDF) |
| 238 | On the mechanism of nonradiative decay of DNA bases: ab initio and TDDFT results for the excited states of 9H-adenine | 1.4 | 196 | Citations (PDF) |
| 239 | Photoinduced Electron and Proton Transfer in Phenol and Its Clusters with Water and Ammonia | 2.7 | 272 | Citations (PDF) |
| 240 | Modeling of ultrafast electron-transfer dynamics: multi-level Redfield theory and validity of approximations | 2.2 | 104 | Citations (PDF) |
| 241 | Ab initio investigation of the potential energy surfaces involved in the photophysics of s-trans-1,3-butadiene | 2.2 | 43 | Citations (PDF) |
| 242 | Theoretical investigation of vibronic-coupling and ultrafast internal-conversion dynamics in the acetylene cation | 2.2 | 16 | Citations (PDF) |
| 243 | Generalized diatomics-in-molecules method for polyatomic anions | 2.7 | 22 | Citations (PDF) |
| 244 | 1–2 conical intersection in trans-butadiene: ultrafast dynamics and optical spectra | 2.8 | 71 | Citations (PDF) |
| 245 | Effect of a dissipative environment on the dynamics at a conical intersection | 2.2 | 33 | Citations (PDF) |
| 246 | Conical intersections induced by repulsive 1πσ* states in planar organic molecules: malonaldehyde, pyrrole and chlorobenzene as photochemical model systems | 2.2 | 218 | Citations (PDF) |
| 247 | Photoejection of electrons from pyrrole into an aqueous environment: ab initio results on pyrrole-water clusters | 2.8 | 58 | Citations (PDF) |
| 248 | Photoinduced charge separation in indole–water clusters | 2.8 | 68 | Citations (PDF) |
| 249 | Electron scattering in cooled HCl: boomerang structures and outer-well resonances in elastic and vibrational excitation cross sections | 1.8 | 35 | Citations (PDF) |
| 250 | Molecular-dynamics simulations of solvent effects in the intramolecular charge transfer of 4-(N,N-dimethylamino)benzonitrile | 2.8 | 38 | Citations (PDF) |
| 251 | Associative detachment, dissociative attachment, and vibrational excitation of HCl by low-energy electrons | 2.7 | 51 | Citations (PDF) |
| 252 | Ab initio study of the amino group twisting and wagging reaction paths in the intramolecular charge transfer of 4-(N,N-dimethylamino)benzonitrile | 2.2 | 58 | Citations (PDF) |
| 253 | On the mechanism of rapid non-radiative decay in intramolecularly hydrogen-bonded π systems | 2.8 | 51 | Citations (PDF) |
| 254 | Potential-energy function for intramolecular proton transfer in the malonaldehyde cation | 2.8 | 5 | Citations (PDF) |
| 255 | Ab initio investigations on the photophysics of indole | 2.8 | 211 | Citations (PDF) |
| 256 | Photophysics of Malonaldehyde: An ab Initio Study | 2.7 | 105 | Citations (PDF) |
| 257 | Ab initio potential-energy functions for excited state intramolecular proton transfer: a comparative study of o-hydroxybenzaldehyde, salicylic acid and 7-hydroxy-1-indanone | 2.8 | 252 | Citations (PDF) |
| 258 | Vibrational coherence in ultrafast electron-transfer dynamics of oxazine 1 in N,N-dimethylaniline: simulation of a femtosecond pump-probe experiment | 2.2 | 65 | Citations (PDF) |
| 259 | Generalization of the nonlocal resonance model for low-energy electron collisions with hydrogen halides: the variable threshold exponent | 1.4 | 17 | Citations (PDF) |
| 260 | Ab initio study of excited-state intramolecular proton dislocation in salicylic acid | 2.2 | 115 | Citations (PDF) |
| 261 | Ab Initio Investigation of Reaction Pathways for Intramolecular Charge Transfer in Dimethylanilino Derivatives | 2.7 | 127 | Citations (PDF) |
| 262 | Theory of vibrational relaxation processes in resonant collisions of low-energy electrons with large molecules | 3.0 | 36 | Citations (PDF) |
| 263 | Nuclear dynamics of the H collision complex beyond the local approximation: associative detachment and dissociative attachment to rotationally and vibrationally excited molecules | 1.8 | 87 | Citations (PDF) |
| 264 | Effect of a thermal bath on electronic resonance decay: A numerical path-integral study | 2.7 | 9 | Citations (PDF) |
| 265 | Photodissociation of ozone in the Chappuis band. III. Product state distributions | 3.0 | 19 | Citations (PDF) |
| 266 | Photodissociation of ozone in the Chappuis band. II. Time-dependent wave-packet calculations and interpretation of diffuse vibrational structures | 3.0 | 39 | Citations (PDF) |
| 267 | Photodissociation of ozone in the Chappuis band. I. Electronic structure calculations | 3.0 | 53 | Citations (PDF) |
| 268 | Model study of near-threshold photoionization of large molecules: The effect of vibrational relaxation | 3.0 | 5 | Citations (PDF) |
| 269 | Mechanism of photoinduced intramolecular charge transfer in aminobenzethynes: an ab initio study | 4.3 | 6 | Citations (PDF) |
| 270 | Femtosecond pump-probe spectroscopy of electron-transfer systems: a nonperturbative approach | 2.2 | 56 | Citations (PDF) |
| 271 | Preface | 2.2 | 22 | Citations (PDF) |
| 272 | Intramolecular electron-transfer dynamics in the inverted regime: quantum mechanical multi-mode model including dissipation | 2.8 | 44 | Citations (PDF) |
| 273 | Promotion of intramolecular charge transfer in dimethylamino derivatives: twisting versus acceptor-group rehybridization | 2.8 | 136 | Citations (PDF) |
| 274 | Charge transfer in aminobenzonitriles: do they twist? | 2.8 | 176 | Citations (PDF) |
| 275 | Real-time path-integral approach for general two-state multi-mode vibronic-coupling models | 2.2 | 7 | Citations (PDF) |
| 276 | Calculation of cross sections for vibrational excitation and dissociative attachment in electron collisions with HBr and DBr | 2.7 | 32 | Citations (PDF) |
| 277 | Calculation of dissociative electron attachment and vibrational excitation cross-section of HBr | 2.8 | 7 | Citations (PDF) |
| 278 | Multi-mode vibronic coupling with dissipation. Application of the Monte Carlo wavefunction propagation method | 2.8 | 52 | Citations (PDF) |
| 279 | Recursive evaluation of the real-time path integral for dissipative systems. The spin-boson model | 2.8 | 30 | Citations (PDF) |
| 280 | A model for the quantum dynamics of Rydberg states of large molecules | 2.8 | 3 | Citations (PDF) |
| 281 | Path-integral treatment of the real-time dynamics of few-mode spin-boson models | 2.2 | 8 | Citations (PDF) |
| 282 | Path‐integral treatment of multi‐mode vibronic coupling. II. Correlation expansion of class averages | 3.0 | 32 | Citations (PDF) |
| 283 | Resonance Raman spectroscopy of theS1andS2states of pyrazine: Experiment and first principles calculation of spectra | 3.0 | 82 | Citations (PDF) |
| 284 | Nonperturbative approach to femtosecond spectroscopy: General theory and application to multidimensional nonadiabatic photoisomerization processes | 3.0 | 200 | Citations (PDF) |
| 285 | Path‐integral treatment of multi‐mode vibronic coupling | 3.0 | 77 | Citations (PDF) |
| 286 | Characterization of theS1–S2conical intersection in pyrazine usingabinitiomulticonfiguration self‐consistent‐field and multireference configuration‐interaction methods | 3.0 | 199 | Citations (PDF) |
| 287 | Diabatic CASSCF orbitals and wavefunctions | 2.8 | 81 | Citations (PDF) |
| 288 | Model studies on femtosecond spectroscopy of multidimensional photoisomerization and internal-conversion dynamics. A nonperturbative approach | 2.8 | 19 | Citations (PDF) |
| 289 | Theoretical investigation of potential energy surfaces relevant for excited-state hydrogen transfer in o-hydroxybenzaldehyde | 2.2 | 98 | Citations (PDF) |
| 290 | Microscopic modelling of photoisomerization and internal-conversion dynamics | 2.2 | 111 | Citations (PDF) |
| 291 | Evidence for the need of a non-Born—Oppenheimer description of excited-state hydrogen transfer | 2.8 | 46 | Citations (PDF) |
| 292 | X̃2AG—Ã 2B1g conical intersection in the pyrazine cation and its effect on the photoelectron spectrum | 2.8 | 26 | Citations (PDF) |
| 293 | Internal conversion funnel in benzene and pyrazine: adiabatic and diabatic representation | 2.8 | 38 | Citations (PDF) |
| 294 | Vibronic coupling in the pE″ Rydberg series of NH3 | 2.8 | 5 | Citations (PDF) |
| 295 | Direct construction of diabatic states in the CASSCF approach. Application to the conical intersection of the 1A2 and 1B1 excited states of ozone | 2.8 | 148 | Citations (PDF) |
| 296 | Time-dependent wave-packet description of dissociative electron attachment | 2.7 | 48 | Citations (PDF) |
| 297 | Femtosecond spectroscopy of ultrafast nonadiabatic excited-state dynamics on the basis of ab initio potential-energy surfaces: the S2 state of pyrazine | 3.3 | 43 | Citations (PDF) |
| 298 | Systematically improved local complex potential approximation for the dynamics of electron-molecule collision complexes | 1.8 | 13 | Citations (PDF) |
| 299 | Path-integral approach to resonant electron-molecule scattering | 2.7 | 30 | Citations (PDF) |
| 300 | Path-integral approach to resonant electron-molecule scattering. II. Second-order cumulant approximation and multimode applications | 2.7 | 13 | Citations (PDF) |
| 301 | Detection of ultrafast molecular-excited-state dynamics with time- and frequency-resolved pump-probe spectroscopy | 2.7 | 89 | Citations (PDF) |
| 302 | Theoretische Chemie 1991 | 0.0 | 0 | Citations (PDF) |
| 303 | Perturbation of the Jahn-Teller effect by partial isotopic substitution: multi-mode vibronic coupling in the X 2E1g and B 2E2g states of 1,4-C6H4D+2 | 2.2 | 17 | Citations (PDF) |
| 304 | Theoretical study of the photoelectron spectrum of allene | 2.2 | 22 | Citations (PDF) |
| 305 | Model study on the real-time detection of ultrafast nonadiabatic dynamics associated with the Wulf-Chappuis bands of ozone | 2.8 | 15 | Citations (PDF) |
| 306 | Model studies on femtosecond time-resolved ionization spectroscopy of excited-state vibrational dynamics and vibronic coupling | 2.2 | 78 | Citations (PDF) |
| 307 | Vibronic coupling in Rydberg series of linear molecules | 2.2 | 4 | Citations (PDF) |
| 308 | Theory of resonance and threshold effects in electron-molecule collisions: The projection-operator approach | 28.7 | 395 | Citations (PDF) |
| 309 | Femtosecond time‐resolved ionization spectroscopy of ultrafast internal‐conversion dynamics in polyatomic molecules: Theory and computational studies | 3.0 | 250 | Citations (PDF) |
| 310 | Ab initio investigation of the multimode dynamical Jahn-Teller effect in the X̃ 2E1g state of the benzene cation | 2.8 | 63 | Citations (PDF) |
| 311 | Jahn—Teller effect of the 2e2g level of chemisorbed benzene | 2.8 | 18 | Citations (PDF) |
| 312 | Photophysically relevant potential energy functions of low-lying singlet states of benzene, pyridine and pyrazine: an ab initio study | 2.8 | 48 | Citations (PDF) |
| 313 | Friction in dissociative attachment | 1.8 | 7 | Citations (PDF) |
| 314 | Non-Markovian dynamics of electron-molecule collision complexes | 2.7 | 19 | Citations (PDF) |
| 315 | MQDT analysis of radiationless decay rates of autoionizing rydberg states of polyatomic molecules | 2.8 | 13 | Citations (PDF) |
| 316 | Surface-hopping-induced femtosecond vibrational dephasing in strongly vibronically coupled systems | 2.8 | 26 | Citations (PDF) |
| 317 | S1-S2 Conical intersection and ultrafast S2→S1 Internal conversion in pyrazine | 2.8 | 95 | Citations (PDF) |
| 318 | Model studies on the time-resolved measurement of excited-state vibrational dynamics and vibronic coupling | 2.2 | 40 | Citations (PDF) |
| 319 | Friction and memory effects in the dynamics of short-lived negative ions | 1.8 | 18 | Citations (PDF) |
| 320 | Model calculation on the pump-probe measurement of ultrafast electronic population decay in polyatomic molecules | 2.8 | 50 | Citations (PDF) |
| 321 | Analytic expressions for the matrix elements of the morse green function with morse wavefunctions | 2.2 | 6 | Citations (PDF) |
| 322 | Direct calculation of complex resonance poles using separable expansions of the potential: Application to theΣu+2shape resonance in electron-H2scattering | 2.7 | 12 | Citations (PDF) |
| 323 | Projection-operator calculations for molecular shape resonances: TheΣu+2resonance in electron-hydrogen scattering | 2.7 | 62 | Citations (PDF) |
| 324 | Nuclear dynamics in resonant electron-molecule scattering beyond the local approximation: Vibrational excitation and dissociative attachment inH2andD2 | 2.7 | 115 | Citations (PDF) |
| 325 | Projection-operator calculations for shape resonances: A new method based on the many-body optical-potential approach | 2.7 | 42 | Citations (PDF) |
| 326 | An accurate potential energy function of the H2− ion at large internuclear distances | 2.8 | 40 | Citations (PDF) |
| 327 | Strong non-adiabatic effects in C2D4+ | 2.8 | 6 | Citations (PDF) |
| 328 | Symmetry Breaking and Non-Born-Oppenheimer Effects in Radical Cations | 5.1 | 59 | Citations (PDF) |
| 329 | Theoretical study of electron transmission through N2 | 2.8 | 4 | Citations (PDF) |
| 330 | Theory of resonance and threshold effects in the electronic excitation of molecules by electron impact | 2.7 | 7 | Citations (PDF) |
| 331 | Nuclear dynamics in resonant electron-molecule scattering beyond the local approximation: The 2.3-eV shape resonance inN2 | 2.7 | 128 | Citations (PDF) |
| 332 | Projection-operator approach to potential scattering | 2.7 | 42 | Citations (PDF) |
| 333 | Strong non-condon effects induced by electron correlation: N2O+ | 2.2 | 44 | Citations (PDF) |
| 334 | The effect of a resonance on vibrational structure in the photoelectron spectrum of acetylene | 2.8 | 47 | Citations (PDF) |
| 335 | On the valence shell binding energy spectrum of carbonyl sulphide | 1.4 | 35 | Citations (PDF) |
| 336 | Green's function calculations on the complete valence ionization spectra of HF, HCl, HBr AND HI | 2.2 | 67 | Citations (PDF) |
| 337 | Spectroscopic effects of conical intersections of molecular potential energy surfaces | 2.4 | 162 | Citations (PDF) |
| 338 | Photon energy dependence of satelite line intensity in the photoelectron spectrum of acetylene | 2.8 | 42 | Citations (PDF) |
| 339 | Two-mode jahn-teller effect in nh+3 | 2.8 | 23 | Citations (PDF) |
| 340 | Effective single-mode Hamiltonian for the calculation of multi-mode Jahn-Teller band shapes | 2.3 | 17 | Citations (PDF) |
| 341 | The E⊗(ϵ + ϵ) Jahn-Teller effect | 2.4 | 45 | Citations (PDF) |
| 342 | Jahn-Teller effect for very strong coupling | 2.4 | 31 | Citations (PDF) |
| 343 | Many-Body Effects in Valence and Core Photoionization of Molecules | 2.6 | 128 | Citations (PDF) |
| 344 | Many-body theory of core holes | 2.7 | 257 | Citations (PDF) |
| 345 | Vibrational State Dependence of the Photoelectron Angular Asymmetry Parameter caused by Vibronic Coupling | 2.6 | 32 | Citations (PDF) |
| 346 | Strong correlation effects in the ionisation of CS2 | 2.8 | 68 | Citations (PDF) |
| 347 | The influence of finite lifetime of electronic states on the vibrational structure of molecular electronic spectra | 2.2 | 92 | Citations (PDF) |
| 348 | Vibronic coupling in linear molecules and linear-to-bent transitions: HCN | 2.2 | 67 | Citations (PDF) |
| 349 | Experimental and theoretical investigation of the complete valence shell ionization spectra of CO2and N2O | 2.2 | 116 | Citations (PDF) |
| 350 | Negative shake-up energy in core ionization | 2.2 | 56 | Citations (PDF) |
| 351 | Jahn—Teller effect induced by non-degenerate vibrational modes in cumulenes | 2.2 | 51 | Citations (PDF) |
| 352 | Electronic recoil effects in high-energy photoelectron spectroscopy | 1.4 | 67 | Citations (PDF) |
| 353 | Breakdown of the molecular orbital picture of ionization for inner valence electrons: experimental and theoretical study of H2S and PH3 | 1.4 | 60 | Citations (PDF) |
| 354 | Complete breakdown of the quasiparticle picture for inner-valence electrons: Hydrogen cyanide and formic acid | 2.8 | 25 | Citations (PDF) |
| 355 | The Jahn-Teller effect in NH3+ | 2.4 | 23 | Citations (PDF) |
| 356 | Intrinsic and extrinsic plasmon coupling in x-ray photoemission from core states of adsorbed atoms | 3.2 | 78 | Citations (PDF) |
| 357 | A comparison of different approaches to the calculation of franck-condon factors for polyatomic molecules | 2.4 | 81 | Citations (PDF) |
| 358 | A difficult assignment problem | 2.4 | 52 | Citations (PDF) |
| 359 | Radiative electron-attachment spectra of O3and SO2 | 2.4 | 24 | Citations (PDF) |
| 360 | Theory of the vibrational structure of resonances in electron-molecule scattering | 2.7 | 114 | Citations (PDF) |
| 361 | On the photoelectron spectrum of PN | 1.4 | 6 | Citations (PDF) |
| 362 | Strong vibronic coupling effects in ionization spectra: The “mystery band” of butatriene | 2.2 | 131 | Citations (PDF) |
| 363 | Vibronic coupling and symmetry breaking in core electron ionization | 2.2 | 164 | Citations (PDF) |
| 364 | Strong Correlation Effects in inner Valence Ionization of N2 AND CO | 2.2 | 144 | Citations (PDF) |
| 365 | Ionization potentials of HCN and HNC by a Green's function method | 2.4 | 34 | Citations (PDF) |
| 366 | Calculation of the HeI photoelectron spectrum of CS including satellite lines | 2.8 | 22 | Citations (PDF) |
| 367 | Ionization potentials of ethylene, allene and butatriene by a green function method | 2.2 | 54 | Citations (PDF) |
| 368 | On the controversial assignment of the ionization potentials of formaldehyde | 2.8 | 40 | Citations (PDF) |
| 369 | On the vibrational structure in inner-shell ionization spectra by a many-body approach | 2.8 | 41 | Citations (PDF) |
| 370 | A theoretical photoelectron spectrum of cyanogen by a Green-function method | 2.2 | 53 | Citations (PDF) |
| 371 | Plasmon coupling to core hole excitations in carbon | 1.5 | 37 | Citations (PDF) |
| 372 | Chemical Reactivity in the Ground and the Excited State 0, , 313-497 | | 2 | Citations (PDF) |
