Related references
Note: Only part of the references are listed.Enhanced photoswitching and ultrafast dynamics in structurally modified photochromic fulgides
F. Renth et al.
INTERNATIONAL REVIEWS IN PHYSICAL CHEMISTRY (2013)
Liquid Water: From Symmetry Distortions to Diffusive Motion
Noam Agmon
ACCOUNTS OF CHEMICAL RESEARCH (2012)
Hydrogen Bonding in the Electronic Excited State
Guang-Jiu Zhao et al.
ACCOUNTS OF CHEMICAL RESEARCH (2012)
On the Role of Hydrogen Bonds in Photoinduced Electron-Transfer Dynamics between 9-Fluorenone and Amine Solvents
Hirendra N. Ghosh et al.
CHEMISTRY-A EUROPEAN JOURNAL (2012)
Time-Dependent Density Functional Theory Study on Excited-State Hydrogen Bonding Dynamics of Acetic Acid Hydrates
Mingxian Ma et al.
JOURNAL OF CLUSTER SCIENCE (2012)
Excited-state hydrogen-bonding dynamics of trans-acetanilide in an aqueous environment: a theoretical study
Xiaoyu Zhang et al.
MOLECULAR SIMULATION (2012)
Excited state intramolecular proton transfer (ESIPT): from principal photophysics to the development of new chromophores and applications in fluorescent molecular probes and luminescent materials
Jianzhang Zhao et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2012)
A theoretical forecast of the hydrogen bond changes in the electronic excited state for BN and its derivatives
Dandan Wang et al.
CENTRAL EUROPEAN JOURNAL OF PHYSICS (2012)
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
Dorit Shemesh et al.
CHEMPHYSCHEM (2011)
Time-Dependent Density Functional Theory Study on the Electronic Excited State of Hydrogen-Bonded Clusters Formed by 2-Hydroxybenzonitrile (o-Cyanophenol) and Carbon Monoxide
Jiazuo Zhang et al.
JOURNAL OF CLUSTER SCIENCE (2011)
A TD-DFT Study on the Cyanide-Chemosensing Mechanism of 8-Formyl-7-hydroxycoumarin
Guang-Yue Li et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2011)
Time-dependent density functional theory study of the excited-state dihydrogen bonding: clusters of 2-pyridone with diethylmethylsilane and triethylgermanium
Ning-Ning Wei et al.
JOURNAL OF MOLECULAR MODELING (2011)
Determination of the Hydrogen-Bonding Induced Local Viscosity Enhancement in Room Temperature Ionic Liquids via Femtosecond Time-Resolved Depleted Spontaneous Emission
Xiaonan Ma et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2011)
Effects of Aggregation on the Excitation Dynamics of LH2 from Thermochromatium tepidum in Aqueous Phase and in Chromatophores
Fan Yang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2011)
A Near-IR Reversible Fluorescent Probe Modulated by Selenium for Monitoring Peroxynitrite and Imaging in Living Cells
Fabiao Yu et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2011)
THEORETICAL STUDY OF THE STEREO-DYNAMICS OF THE REACTION O plus HCl → ClO plus H
Qiang Wei et al.
JOURNAL OF THEORETICAL & COMPUTATIONAL CHEMISTRY (2011)
Core-shell effects in the ionization of doped helium nanodroplets
Jun Liu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Dispersion interactions of carbohydrates with condensate aromatic moieties: Theoretical study on the CH-pi interaction additive properties
Stanislav Kozmon et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Structures and IR/UV spectra of neutral and ionic phenol-Ar-n cluster isomers (n <= 4): competition between hydrogen bonding and stacking
Matthias Schmies et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Dimers of cyclic carbonates: chirality recognition in battery solvents and energy storage
Franz Kollipost et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
An ab initio study of cooperative effects in ternary complexes X:CNH:Z with X, Z=CNH, FH, ClH, FCl, and HLi: structures, binding energies, and spin-spin coupling constants across intermolecular bonds
Janet E. Del Bene et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Experimental and theoretical determination of the accurate CH/pi interaction energies in benzene-alkane clusters: correlation between interaction energy and polarizability
Asuka Fujii et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Intramolecular OH center dot center dot center dot pi interactions in alkenols and alkynols
Benjamin J. Miller et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Infrared and microwave spectra of the acetylene-ammonia and carbonyl sulfide-ammonia complexes: a comparative study of a weak C-H center dot center dot center dot N hydrogen bond and an S center dot center dot center dot N bond
Xunchen Liu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
The boron-boron single bond in diborane(4) as a non-classical electron donor for hydrogen bonding
Ibon Alkorta et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Weak hydrogen bonds - strong effects?
W. A. Herrebout et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Spectral and intramolecular charge transfer properties in terminal donor/acceptor-substituted all-trans-alpha,omega-diphenylpolyenes and alpha,omega-diphenylpolyynes
Xiaonan Ma et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
On the weak O-H center dot center dot center dot halogen hydrogen bond: a rotational study of CH3CHClF center dot center dot center dot H2O
Gang Feng et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Comparison of the performance of dispersion-corrected density functional theory for weak hydrogen bonds
Waldemar Hujo et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
Dynamics of the intermolecular hydrogen bonds in the polymorphs of paracetamol in relation to crystal packing and conformational transitions: a variable-temperature polarized Raman spectroscopy study
Boris A. Kolesov et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2011)
DFT/TDDFT study on the excited-state hydrogen bonding dynamics of hydrogen-bonded complex formed by methyl cyanide and methanol
Hongfei Wang et al.
COMPUTATIONAL AND THEORETICAL CHEMISTRY (2011)
Excited-state hydrogen bonding dynamics of methyl isocyanide in methanol solvent: A DFT/TDDFT study
Hongfei Wang et al.
CENTRAL EUROPEAN JOURNAL OF PHYSICS (2011)
Time-dependent density functional theory study of the excited-state dihydrogen bond O-H•••H-Si
Ningning Wei et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY (2010)
Fluorescence quenching phenomena facilitated by excited-state hydrogen bond strengthening for fluorenone derivatives in alcohols
Yu-Hui Liu et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY (2010)
Structure-Dependent All-Optical Switching in Graphene-Nanoribbon-Like Molecules: Fully Conjugated Tri(perylene bisimides)
Huan Wang et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Photophysical Properties of Intramolecular Charge Transfer in Two Newly Synthesized Tribranched Donor-π-Acceptor Chromophores
Mingli Jia et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Theory of Excited State Decays and Optical Spectra: Application to Polyatomic Molecules
Yingli Niu et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
The Effect of Intermolecular Hydrogen Bonding on the Fluorescence of a Bimetallic Platinum Complex
Guang-Jiu Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2010)
Gigantic Two-Photon Absorption Cross Sections and Strong Two-Photon Excited Fluorescence in Pyrene Core Dendrimers with Fluorene/Carbazole as Dendrons and Acetylene as Linkages
Yan Wan et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2010)
Theoretical Insight into the Photodegradation of a Disulfide Bridged Cyclic Tetrapeptide in Solution and Subsequent Fast Unfolding-Refolding Events
Xuebo Chen et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2010)
Time-dependent density functional theory study on the coexistent intermolecular hydrogen-bonding and dihydrogen-bonding of the phenol-H2O-diethylmethylsilane complex in electronic excited states
Ning-Ning Wei et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Role of excited-state hydrogen detachment and hydrogen-transfer processes for the excited-state deactivation of an aromatic dipeptide: N-acetyl tryptophan methyl amide
Dorit Shemesh et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2010)
Chromogenic anionic chemosensors based on protonated merocyanine solvatochromic dyes: Influence of the medium on the quantitative and naked-eye selective detection of anionic species
Lizandra Maria Zimmermann-Dimer et al.
DYES AND PIGMENTS (2009)
Theoretical Insights into Hydrogen Bonding and Its Influence on the Structural and Spectral Properties of Aquo Palladium(II) Complexes: cis-[(dppp)Pd(H2O)2]2+, cis-[(dppp)Pd(H2O)(OSO2CF3)]+(OSO2CF3)-, and cis-[(dppp)Pd(H2O)2]2+(OSO2CF3)2-
Guang-Jiu Zhao et al.
JOURNAL OF CHEMICAL THEORY AND COMPUTATION (2009)
Role of Intramolecular and Intermolecular Hydrogen Bonding in Both Singlet and Triplet Excited States of Aminofluorenones on Internal Conversion, Intersystem Crossing, and Twisted Intramolecular Charge Transfer
Guang-Jiu Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2009)
Exploration of the Dynamical Evolution and the Associated Energetics of Water Nanoclusters Formed in a Hydrophobic Solvent
Rajib Kumar Mitra et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2009)
Excited State Localization and Delocalization of Internal Charge Transfer in Branched Push-Pull Chromophores Studied by Single-Molecule Spectroscopy
Damir Aumiler et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Isolated Seven-Coordinate Ru(IV) Dimer Complex with [HOHOH]- Bridging Ligand as an Intermediate for Catalytic Water Oxidation
Lele Duan et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2009)
Theoretical study of proton encircling modes in proton sponges with tetraamido/diamino quaternized macrocycles: the role of pi-conjugated and aliphatic bridges
Nan Jiang et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
IR spectroscopy applied subsequent to a proton transfer reaction in the excited state of isolated 3-hydroxyflavone and 2-(2-naphthyl)-3-hydroxychromone
K. Bartl et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Reconsideration of the excited-state double proton transfer (ESDPT) in 2-aminopyridine/acid systems: role of the intermolecular hydrogen bonding in excited states
Shuo Chai et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2009)
Ab initio determination of dark structures in radiationless transitions for aromatic carbonyl compounds
Wei-Hai Fang
ACCOUNTS OF CHEMICAL RESEARCH (2008)
Site-specific solvation of the photoexcited protochlorophyllide a in methanol: Formation of the hydrogen-bonded intermediate state induced by hydrogen-bond strengthening
Guang-Jiu Zhao et al.
BIOPHYSICAL JOURNAL (2008)
Effects of hydrogen bonding on tuning photochemistry: Concerted hydrogen-bond strengthening and weakening
Guang-Jiu Zhao et al.
CHEMPHYSCHEM (2008)
Time-dependent density functional theory study on hydrogen-bonded intramolecular charge-transfer excited state of 4-dimethylamino-benzonitrile in methanol
Guang-Jiu Zhao et al.
JOURNAL OF COMPUTATIONAL CHEMISTRY (2008)
Environment sensitive phenothiazine dyes strongly fluorescence in protic solvents
Feng Han et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY (2008)
Ab initio QM/MM molecular dynamics study on the excited-state hydrogen transfer of 7-azaindole in water solution
Daisuke Kina et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2008)
Photophysical characters of rationally designed hetero-ring-expanded guanine analogues and effect of cytosine pairing
Laibin Zhang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2008)
Luminescence depolarization dynamics of quantum dots: Is it hydrodynamic rotation or exciton migration?
S. Shankara Narayanan et al.
JOURNAL OF PHYSICAL CHEMISTRY C (2008)
Nonadiabatic deactivation of 9H-adenine:: A comprehensive picture based on mixed quantum-classical dynamics
Mario Barbatti et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2008)
Effect of Coriolis coupling in chemical reaction dynamics
Tian-Shu Chu et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2008)
Photochemistry of hydrogen-bonded aromatic pairs: Quantum dynamical calculations for the pyrrole-pyridine complex
Zhenggang Lan et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2008)
Photochemistry of aryl halides: Photodissociation dynamics
Ke-Li Han et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY C-PHOTOCHEMISTRY REVIEWS (2007)
Ultrafast hydrogen bond strengthening of the photoexcited fluorenone in alcohols for facilitating the fluorescence Quenching
Guang-Jiu Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Significant nonadiabatic effects in the S(1D)+HD reaction
Tian-Shu Chu et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Raman jet spectroscopy of formic acid dimers: low frequency vibrational dynamics and beyond
P. Zielke et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
Site-selective photoinduced electron transfer from alcoholic solvents to the chromophore facilitated by hydrogen bonding: A new fluorescence quenching mechanism
Guang-Jiu Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2007)
Novel infrared spectra for intermolecular dihydrogen bonding of the phenol-borane-trimethylamine complex in electronically excited state
Guang-Jiu Zhao et al.
JOURNAL OF CHEMICAL PHYSICS (2007)
Dihydrogen complexes as prototypes for the coordination chemistry of saturated molecules
Gregory J. Kubas
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2007)
Estimation on the individual hydrogen-bond strength in molecules with multiple hydrogen bonds
Hao Dong et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Early time hydrogen-bonding dynamics of photoexcited coumarin 102 in hydrogen-donating solvents: Theoretical study
Guang-Jiu Zhao et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
The ultrafast dynamics of near-infrared heptamethine cyanine dye in alcoholic and aprotic solvents
Li-Chuan Zhou et al.
CHEMICAL PHYSICS (2007)
The lowest singlet (n,π*) and (π,π*) excited states of the hydrogen-bonded complex between water and pyrazine
Zheng-Li Cai et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2007)
Energy-gaining formation and catalytic behavior of active structures in a SiO2-supported unsaturated Ru complex catalyst for alkene epoxidation by DFT calculations
Rudy Coquet et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2007)
A new fluorescein derivative bearing a boronic acid group as a fluorescent chemosensor for fluoride ion
K. M. K. Swamy et al.
JOURNAL OF ORGANIC CHEMISTRY (2006)
Theoretical study of dihydrogen bonds between (XH)2, X = Li, Na, BeH, and MgH, and weak hydrogen bond donors (HCN, HNC, and HCCH)
Ibon Alkorta et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2006)
Photophysics of intramolecularly hydrogen-bonded aromatic systems:: ab initio exploration of the excited-state deactivation mechanisms of salicylic acid
Andrzej L. Sobolewski et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2006)
Complete infrared spectroscopic characterization of phenol-borane-trimethylamine dihydrogen-bonded complex in the gas phase
G. Naresh Patwari et al.
JOURNAL OF CHEMICAL PHYSICS (2006)
Coexistence of dihydrogen, blue- and red-shifting hydrogen bonds in an ultrasmall system: Valine
WB Yu et al.
CHEMPHYSCHEM (2006)
First fluorescent sensor for fluoride based on 2-ureido-4[1H]-pyrimidinone quadruple hydrogen-bonded AADD supramolecular assembly
YP Zhao et al.
JOURNAL OF ORGANIC CHEMISTRY (2006)
Control of structure and photophysical properties by protonation and subsequent intramolecular hydrogen bonding
MT Sun
JOURNAL OF CHEMICAL PHYSICS (2006)
Transition in the temperature-dependence of GFP fluorescence: From proton wires to proton exit
P Leiderman et al.
BIOPHYSICAL JOURNAL (2006)
Colorimetric and ratiometric fluorescence sensing of fluoride: Tuning selectivity in proton transfer
XJ Peng et al.
JOURNAL OF ORGANIC CHEMISTRY (2005)
High-pressure Raman studies on aqueous protonated thiazole:: Presence of charge-enhanced C-H•••O hydrogen bonds
HC Chang et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2005)
Interrelation between H-bond and Pi-electron delocalization
L Sobczyk et al.
CHEMICAL REVIEWS (2005)
Diverse world of unconventional hydrogen bonds
NV Belkova et al.
ACCOUNTS OF CHEMICAL RESEARCH (2005)
Fluorescence enhancement of curcumin upon inclusion into parent and modified cyclodextrins
KN Baglole et al.
JOURNAL OF PHOTOCHEMISTRY AND PHOTOBIOLOGY A-CHEMISTRY (2005)
Comparing polarizable force fields to ab initio calculations reveals nonclassical effects in condensed phases -: art. no. 234107
R Chelli et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
A quantum wave-packet study of intersystem crossing effects in the O(3P2,1,0,1D2)+H2 reaction -: art. no. 214301
TS Chu et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Systematic ab initio studies of the conformers and conformational distribution of gas-phase tyrosine -: art. no. 134313
ML Zhang et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
A vibrational spectral maker for probing the hydrogen-bonding status of protonated Asp and Glu residues
BN Nie et al.
BIOPHYSICAL JOURNAL (2005)
Nonadiabatic time-dependent wave packet study of the D++H2 reaction system
TS Chu et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2005)
Analytical time-dependent density functional derivative methods within the RI-J approximation, an approach to excited states of large molecules -: art. no. 064105
D Rappoport et al.
JOURNAL OF CHEMICAL PHYSICS (2005)
Strong dihydrogen bonds - ab initio and atoms in molecules study
SJ Grabowski et al.
CHEMICAL PHYSICS LETTERS (2004)
Nuclear second analytical derivative calculations using auxiliary basis set expansions
P Deglmann et al.
CHEMICAL PHYSICS LETTERS (2004)
Solvent effects on the fluorescence depolarization rates of Coumarins in solution: The likely influence of site-selective hydrogen bonding
TG Kim et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Time-dependent density functional methods for excited state properties (vol 117, pg 7433, 2002)
F Furche et al.
JOURNAL OF CHEMICAL PHYSICS (2004)
Intramolecular hydrogen bonding in the S1(ππ*) excited state of anthranilic acid and salicylic acid:: TDDFT calculation of excited-state geometries and infrared spectra
AL Sobolewski et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2004)
Vibrational study of the S-0 and S-1 states of 2-naphthyl-1-ethanol/(water)(2) and 2-naphthyl-1-ethanol/(methanol)(2) complexes by IR/UV double resonance spectroscopy
N Seurre et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2004)
Efficient evaluation of three-center two-electron integrals over Gaussian functions
R Ahlrichs
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2004)
Probing the threshold to H atom transfer along a hydrogen-bonded ammonia wire
C Tanner et al.
SCIENCE (2003)
Electronic and vibrational spectroscopy of jet-cooled m-cyanophenol and its dimer:: laser-induced fluorescence and fluorescence-dip IR spectra in the S0 and S1 states
N Seurre et al.
CHEMICAL PHYSICS (2003)
Analytic gradients for excited states in the coupled-cluster model CC2 employing the resolution-of-the-identity approximation
A Köhn et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Comparison between hydrogen and dihydrogen bonds among H3BNH3, H2BNH2, and NH3
T Kar et al.
JOURNAL OF CHEMICAL PHYSICS (2003)
Ground and excited-state acetic acid catalyzed double proton transfer in 2-aminopyridine
FT Hung et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Surface-binding forms of carboxylic groups on nanoparticulate TiO2 surface studied by the interface-sensitive transient triplet-state molecular probe
YX Weng et al.
JOURNAL OF PHYSICAL CHEMISTRY B (2003)
Geometry optimizations with the coupled-cluster model CC2 using the resolution-of-the-identity approximation
C Hättig
JOURNAL OF CHEMICAL PHYSICS (2003)
Singlet and triplet valence excited states of pyrimidine
G Fischer et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2003)
Solvation dynamics and proton transfer in supramolecular assemblies
K Bhattacharyya
ACCOUNTS OF CHEMICAL RESEARCH (2003)
Supramolecular systems as microreactors: Control of product selectivity in organic phototransformation
CH Tung et al.
ACCOUNTS OF CHEMICAL RESEARCH (2003)
Adiabatic time-dependent density functional methods for excited state properties
F Furche et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Gas phase dihydrogen bonding: clusters of borane-amines with phenol and aniline
GN Patwari et al.
CHEMICAL PHYSICS (2002)
Infrared spectroscopy of jet-cooled, electronically excited clusters of Coumarin 151: excited-state interactions and conformational relaxation
Y Chen et al.
INTERNATIONAL JOURNAL OF MASS SPECTROMETRY (2002)
The first singlet (n,π*) and (π,π*) excited states of the hydrogen-bonded complex between water and pyridine
ZL Cai et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2002)
An infrared study of π-hydrogen bonds in micro-solvated phenol:: OH stretching vibrations of phenol-X (X = C6H6, C2H4, and C2H2) clusters in the neutral and cationic ground states
A Fujii et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2002)
New types of hydrogen bonding in organometallic chemistry
LM Epstein et al.
COORDINATION CHEMISTRY REVIEWS (2002)
An efficient implementation of second analytical derivatives for density functional methods
P Deglmann et al.
CHEMICAL PHYSICS LETTERS (2002)
An improved method for density functional calculations of the frequency-dependent optical rotation
S Grimme et al.
CHEMICAL PHYSICS LETTERS (2002)
Dihydrogen bonded phenol-borane-dimethylamine complex: An experimental and theoretical study
GN Patwari et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Picosecond dynamics of stepwise double proton-transfer reaction in the excited state of the 2-aminopyridine/acetic acid system
H Ishikawa et al.
JOURNAL OF PHYSICAL CHEMISTRY A (2002)
A fully direct RI-HF algorithm: Implementation, optimised auxiliary basis sets, demonstration of accuracy and efficiency
F Weigend
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2002)
Excited-state hydrogen detachment and hydrogen transfer driven by repulsive (1)pi sigma* states: A new paradigm for nonradiative decay in aromatic biomolecules
AL Sobolewski et al.
PHYSICAL CHEMISTRY CHEMICAL PHYSICS (2002)
B-H delta-sigma bond as dihydrogen bond acceptor: Some theoretical observations and predictions
JS Li et al.
JOURNAL OF CHEMICAL PHYSICS (2002)
Modeling the bacterial photosynthetic reaction center.: 4.: The structural, electrochemical, and hydrogen-bonding properties of 22 mutants of Rhodobacter sphaeroides
JM Hughes et al.
JOURNAL OF THE AMERICAN CHEMICAL SOCIETY (2001)
Dihydrogen bonding: Structures, energetics, and dynamics
R Custelcean et al.
CHEMICAL REVIEWS (2001)
Catalytic role of enzymes: Short strong H-bond-induced partial proton shuttles and charge redistributions
KS Kim et al.
PROCEEDINGS OF THE NATIONAL ACADEMY OF SCIENCES OF THE UNITED STATES OF AMERICA (2000)