Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
about
Concerted hydrogen-bond breaking by quantum tunneling in the water hexamer prism.Water-water and water-solute interactions in microsolvated organic complexes.Structures of cage, prism, and book isomers of water hexamer from broadband rotational spectroscopy.Water clusters: untangling the mysteries of the liquid, one molecule at a timeWater clusters on Cu(110): chain versus cyclic structures.Mid-infrared signatures of hydroxyl containing water clusters: Infrared laser Stark spectroscopy of OH-H2O and OH(D2O)n (n = 1-3).Infrared spectroscopy of the ν2 band of the water monomer and small water clusters (H2O)n=2,3,4 in helium droplets.Observable-targeting global cluster structure optimization.Binding water to a PEG-linked flexible bichromophore: IR spectra of diphenoxyethane-(H₂O)n clusters, n = 2-4.Clusters of classical water models.A systematic development of a polarizable potential of water.Hydrogen-bond cooperative effects in small cyclic water clusters as revealed by the interacting quantum atoms approach.An ab initio study of tunneling splittings in the water dimer.Elucidating the role of many-body forces in liquid water. I. Simulations of water clusters on the VRT(ASP-W) potential surfaces.Optimal geometries and harmonic vibrational frequencies of the global minima of water clusters (H2O)n, n = 2-6, and several hexamer local minima at the CCSD(T) level of theory.Hydrogen bond cooperativity and anticooperativity within the water hexamer.An ab initio study of tunneling splittings in the water trimer.Instanton calculations of tunneling splittings for water dimer and trimer.Sources of the deficiencies in the popular SPC/E and TIP3P models of water.Simulations of vapor water clusters at vapor-liquid equilibrium.Unusual H-Bond Topology and Bifurcated H-bonds in the 2-Fluoroethanol Trimer.Communication: Isotopic effects on tunneling motions in the water trimer.Classification of hydrogen bond flips in small water polyhedra applied to concerted proton tunneling.Charge-on-spring polarizable water models revisited: From water clusters to liquid water to iceQuantitative characterization of the (D2O)3 torsional manifold by terahertz laser spectroscopy and theoretical analysisQuantitative characterization of the water trimer torsional manifold by terahertz laser spectroscopy and theoretical analysis. II. (H2O)3Far infrared VRT spectroscopy of two water trimer isotopomers vibrationally averaged structures and rearrangement dynamicsHarmonic vibrational frequencies of the water monomer and dimer: Comparison of various levels of ab initio theoryWater-cluster distribution with respect to pressure and temperature in the gas phaseWhat is the best density functional to describe water clusters: evaluation of widely used density functionals with various basis sets for (H2O) n (n = 1–10)Quantum initial value representation simulation of water trimer far infrared absorption spectrum
P2860
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P2860
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
description
1992 nî lūn-bûn
@nan
1992 թուականի Սեպտեմբերին հրատարակուած գիտական յօդուած
@hyw
1992 թվականի սեպտեմբերին հրատարակված գիտական հոդված
@hy
1992年の論文
@ja
1992年論文
@yue
1992年論文
@zh-hant
1992年論文
@zh-hk
1992年論文
@zh-mo
1992年論文
@zh-tw
1992年论文
@wuu
name
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@ast
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@en
type
label
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@ast
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@en
prefLabel
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@ast
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@en
P356
P1433
P1476
Measurement of quantum tunneling between chiral isomers of the cyclic water trimer.
@en
P2093
Pugliano N
Saykally RJ
P304
P356
10.1126/SCIENCE.1411509
P407
P577
1992-09-01T00:00:00Z