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Charge-Transfer Energy in the Water−Hydrogen Molecular Aggregate Revealed by Molecular-Beam Scattering Experiments, Charge Displacement Analysis, and ab Initio Calculations

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What this work says

Outgoing claims: the papers this work cites, builds on, or argues with.

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Permanent and Induced Molecular Moments and Long‐Range Intermolecular Forces
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Glory‐Scattering Measurement of Water–Noble‐Gas Interactions: The Birth of the Hydrogen Bond
inferredcites →https://doi.org/10.1002/chem.200802107openalex-snapshot
Electron Donation in the Water–Water Hydrogen Bond
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Generalization to ion—neutral systems of the polarizability correlations for interaction potential parameters
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A comparison of the efficiency and accuracy of the quadratic configuration interaction (QCISD), coupled cluster (CCSD), and Brueckner coupled cluster (BCCD) methods
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Perturbative corrections to account for triple excitations in closed and open shell coupled cluster theories
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Ab initio calculations on intermolecular forces. II. An analysis of potential energy curves for HE… HF, He… H2O, H2… HF and H2 … H2O at large and intermediate distances
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Atom–bond pairwise additive representation for intermolecular potential energy surfaces
inferredcites →https://doi.org/10.1016/j.cplett.2008.11.009openalex-snapshot
Hydrogen bonding with a hydrogen bond: The methane–water complex and the penta-coordinate carbon
inferredcites →https://doi.org/10.1016/j.cplett.2009.03.073openalex-snapshot
Charge-transfer in Symmetry-Adapted Perturbation Theory
inferredcites →https://doi.org/10.1016/j.ijms.2008.07.018openalex-snapshot
On the development of an effective model potential to describe water interaction in neutral and ionic clusters
inferredcites →https://doi.org/10.1021/cr00088a005openalex-snapshot
Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint
inferredcites →https://doi.org/10.1021/j100338a029openalex-snapshot
Molecular beam studies of weak interactions for open shell systems: spin-orbit dependence of the potential energy surface for atomic oxygen(3P) with hydrogen and methane
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The Chemical Bond between Au(I) and the Noble Gases. Comparative Study of NgAuF and NgAu + (Ng = Ar, Kr, Xe) by Density Functional and Coupled Cluster Methods
inferredcites →https://doi.org/10.1021/jp0202486openalex-snapshot
Molecular Beam Scattering Experiments on Benzene−Rare Gas Systems: Probing the Potential Energy Surfaces for the C6H6−He, −Ne, and −Ar Dimers
inferredcites →https://doi.org/10.1021/jp067318jopenalex-snapshot
Hydrogen Molecules in the Small Dodecahedral Cage of a Clathrate Hydrate: Quantum Translation−Rotation Dynamics of the Confined Molecules
inferredcites →https://doi.org/10.1021/jp9051819openalex-snapshot
Potential Energy Surface for the H2O−H2 System
inferredcites →https://doi.org/10.1021/jp905584popenalex-snapshot
Molecular-Beam Scattering Experiments and Theoretical Calculations Probing Charge Transfer in Weakly Bound Complexes of Water
inferredcites →https://doi.org/10.1038/nchem.580openalex-snapshot
Binding energies, lifetimes and implications of bulk and interface solvated electrons in water
inferredcites →https://doi.org/10.1039/b808524bopenalex-snapshot
Beyond the Lennard-Jones model: a simple and accurate potential function probed by high resolution scattering data useful for molecular dynamics simulations
inferredcites →https://doi.org/10.1039/b914792fopenalex-snapshot
Experimental and theoretical evidence of charge transfer in weakly bound complexes of water
inferredcites →https://doi.org/10.1039/ft9938902239openalex-snapshot
Computation of inelastic rotational rates and collision cross-sections for astrophysically important systems: H2+ H2O and the water maser
inferredcites →https://doi.org/10.1051/0004-6361/200810680openalex-snapshot
Rotational excitation of ortho-H2O by para-H2 (j2 = 0, 2, 4, 6, 8) at high temperature
inferredcites →https://doi.org/10.1051/0004-6361/201014603openalex-snapshot
Water cooling of shocks in protostellar outflows
inferredcites →https://doi.org/10.1051/0004-6361:20021897openalex-snapshot
Location of H2O maser in the double-nuclei system of NGC 6240
inferredcites →https://doi.org/10.1051/0004-6361:20065804openalex-snapshot
Influence of a new potential energy surface on the rotational (de)excitation of H$_{\mathsf 2}$O by H$_{\mathsf 2}$ at low temperature
inferredcites →https://doi.org/10.1051/0004-6361:20077678openalex-snapshot
Quasi-classical rate coefficient calculations for the rotational (de)excitation of H2O by H2
inferredcites →https://doi.org/10.1051/0004-6361:200810717openalex-snapshot
Collisional excitation of water in warm astrophysical media
inferredcites →https://doi.org/10.1063/1.1630960openalex-snapshot
Intermolecular potential and second virial coefficient of the water–hydrogen complex
inferredcites →https://doi.org/10.1063/1.2988314openalex-snapshot
R12-calibrated H2O–H2 interaction: Full dimensional and vibrationally averaged potential energy surfaces
inferredcites →https://doi.org/10.1063/1.456101openalex-snapshot
The rotational Raman spectrum of H2 in water
inferredcites →https://doi.org/10.1063/1.456153openalex-snapshot
Gaussian basis sets for use in correlated molecular calculations. I. The atoms boron through neon and hydrogen
inferredcites →https://doi.org/10.1063/1.459822openalex-snapshot
A potential energy surface for the process H2+H2O→H+H+H2O : A b i n i t i o calculations and analytical representation
inferredcites →https://doi.org/10.1063/1.461035openalex-snapshot
Generalized correlations in terms of polarizability for van der Waals interaction potential parameter calculations
inferredcites →https://doi.org/10.1063/1.462569openalex-snapshot
Electron affinities of the first-row atoms revisited. Systematic basis sets and wave functions
inferredcites →https://doi.org/10.1063/1.462645openalex-snapshot
Intermolecular potential of H2O⋅⋅⋅H2 in the van der Waals region. An a b i n i t i o study
inferredcites →https://doi.org/10.1063/1.463240openalex-snapshot
Experimental and simulated vibrational spectra of H2 absorbed in amorphous ice: Surface structures, energetics, and relaxations
inferredcites →https://doi.org/10.1063/1.467297openalex-snapshot
Anisotropic rigid rotor potential energy function for H2O–H2
inferredcites →https://doi.org/10.1063/1.472127openalex-snapshot
A reliable new potential energy surface for H2–Ar
inferredcites →https://doi.org/10.1063/1.476989openalex-snapshot
Scattering of aligned molecules. The potential energy surfaces for the Kr-O2 and Xe-O2 systems
inferredcites →https://doi.org/10.1063/1.478091openalex-snapshot
High-resolution diode laser study of H2–H2O van der Waals complexes: H2O as proton acceptor and the role of large amplitude motion
inferredcites →https://doi.org/10.1073/pnas.0307449100openalex-snapshot
Hydrogen storage in molecular compounds
inferredcites →https://doi.org/10.1073/pnas.0508231103openalex-snapshot
Molecular complexes in close and far away
inferredcites →https://doi.org/10.1080/00268970009483379openalex-snapshot
Coupling by charge transfer: role in bond stabilization for open-shell systems and ionic molecules and in harpooning and proton attachment processes
inferredcites →https://doi.org/10.1080/01442350600674033openalex-snapshot
Experimental benchmarks and phenomenology of interatomic forces: open-shell and electronic anisotropy effects
inferredcites →https://doi.org/10.1086/312843openalex-snapshot
Implications of [ITAL]Submillimeter Wave Astronomy Satellite[/ITAL] Observations for Interstellar Chemistry and Star Formation
inferredcites →https://doi.org/10.1086/342167openalex-snapshot
Laboratory Spectroscopy of Hot Water near 2 Microns and Sunspot Spectroscopy in the H‐Band Region
inferredcites →https://doi.org/10.1086/342749openalex-snapshot
Water Maser Survey toward Low‐Mass Young Stellar Objects in the Northern Sky with the Nobeyama 45 Meter Telescope and the Very Large Array
inferredcites →https://doi.org/10.1086/375024openalex-snapshot
Submillimeter Wave Astronomy SatelliteMapping Observations of Water Vapor around Sagittarius B2
inferredcites →https://doi.org/10.1086/508259openalex-snapshot
The Water Vapor Abundance in Orion KL Outflows
inferredcites →https://doi.org/10.1088/0022-3700/8/18/022openalex-snapshot
Molecular beam scattering experiments with polar molecules: measurement of differential collision cross sections for H2O+H2, He, Ne, Ar, H2O and NH3+H2, He, NH3
inferredcites →https://doi.org/10.1088/0031-8949/78/03/038102openalex-snapshot
Benchmarking a model potential for the investigation of intermolecular interactions
inferredcites →https://doi.org/10.1126/science.1075394openalex-snapshot
Hydrogen Clusters in Clathrate Hydrate

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