220 related articles for article (PubMed ID: 16833512)
21. On the unusual properties of halogen bonds: a detailed ab initio study of X2-(H2O)(1-5) clusters (X = Cl and Br).
Bernal-Uruchurtu MI; Hernández-Lamoneda R; Janda KC
J Phys Chem A; 2009 May; 113(19):5496-505. PubMed ID: 19368400
[TBL] [Abstract][Full Text] [Related]
22. Interaction in the ternary complexes of HNO3···HCl···H2O: a theoretical study on energetics, structure, and spectroscopy.
Balcı FM; Uras-Aytemiz N
J Phys Chem A; 2011 Jun; 115(23):5943-54. PubMed ID: 21410276
[TBL] [Abstract][Full Text] [Related]
23. On the extent of intramolecular hydrogen bonding in gas-phase and hydrated 1,2-ethanediol.
Crittenden DL; Thompson KC; Jordan MJ
J Phys Chem A; 2005 Mar; 109(12):2971-7. PubMed ID: 16833617
[TBL] [Abstract][Full Text] [Related]
24. Comparison of hydrated hydroperoxide anion (HOO-)(H2O)n clusters with alkaline hydrogen peroxide (HOOH)(OH-)(H2O)(n-1) clusters, n = 1-8, 20: an ab initio study.
Anick DJ
J Phys Chem A; 2011 Jun; 115(24):6327-38. PubMed ID: 21604682
[TBL] [Abstract][Full Text] [Related]
25. H atom transfer along an ammonia chain: tunneling and mode selectivity in 7-hydroxyquinoline.(NH3)3.
Manca C; Tanner C; Coussan S; Bach A; Leutwyler S
J Chem Phys; 2004 Aug; 121(6):2578-90. PubMed ID: 15281856
[TBL] [Abstract][Full Text] [Related]
26. Ammonia-water cation and ammonia dimer cation.
Kim H; Lee HM
J Phys Chem A; 2009 Jun; 113(25):6859-64. PubMed ID: 19534557
[TBL] [Abstract][Full Text] [Related]
27. Excited state hydrogen transfer in fluorophenol.ammonia clusters studied by two-color REMPI spectroscopy.
Tsuji N; Ishiuchi S; Sakai M; Fujii M; Ebata T; Jouvet C; Dedonder-Lardeux C
Phys Chem Chem Phys; 2006 Jan; 8(1):114-21. PubMed ID: 16482250
[TBL] [Abstract][Full Text] [Related]
28. Microsolvation of methyl hydrogen peroxide: ab initio quantum chemical approach.
Kulkarni AD; Rai D; Bartolotti LJ; Pathak RK
J Chem Phys; 2009 Aug; 131(5):054310. PubMed ID: 19673565
[TBL] [Abstract][Full Text] [Related]
29. Hydrogen peroxide clusters: the role of open book motif in cage and helical structures.
Elango M; Parthasarathi R; Subramanian V; Ramachandran CN; Sathyamurthy N
J Phys Chem A; 2006 May; 110(19):6294-300. PubMed ID: 16686465
[TBL] [Abstract][Full Text] [Related]
30. Theoretical studies on photoelectron and IR spectral properties of Br2.-(H2O)n clusters.
Pathak AK; Mukherjee T; Maity DK
J Chem Phys; 2007 Jul; 127(4):044304. PubMed ID: 17672687
[TBL] [Abstract][Full Text] [Related]
31. Microscopic solvation of a lithium atom in water-ammonia mixed clusters: solvent coordination and electron localization in presence of a counterion.
Pratihar S; Chandra A
J Chem Phys; 2008 Jul; 129(2):024511. PubMed ID: 18624542
[TBL] [Abstract][Full Text] [Related]
32. Theoretical analysis of pyridine protonation in water clusters of increasing size.
Sicilia MC; Muñoz-Caro C; Niño A
Chemphyschem; 2005 Jan; 6(1):139-47. PubMed ID: 15688657
[TBL] [Abstract][Full Text] [Related]
33. Cooperativity and proton transfer in hydrogen-bonded triads.
Mó O; Yáñez M; Del Bene JE; Alkorta I; Elguero J
Chemphyschem; 2005 Jul; 6(7):1411-8. PubMed ID: 15942970
[TBL] [Abstract][Full Text] [Related]
34. Quantum proton transfer in hydrated sulfuric acid clusters: a perspective from semiempirical path integral simulations.
Sugawara S; Yoshikawa T; Takayanagi T; Shiga M; Tachikawa M
J Phys Chem A; 2011 Oct; 115(42):11486-94. PubMed ID: 21910433
[TBL] [Abstract][Full Text] [Related]
35. Direct ab initio dynamics calculations for rates and the kinetic isotope effects of multiproton transfer in ClONO2 + HCl --> HNO3 + Cl2 reactions with water clusters: breakdown of the rule of the geometric mean.
Nam K; Kim Y
J Chem Phys; 2009 Apr; 130(14):144310. PubMed ID: 19368448
[TBL] [Abstract][Full Text] [Related]
36. Clusters of hydrated methane sulfonic acid CH3SO3H.(H2O)n (n = 1-5): a theoretical study.
Wang L
J Phys Chem A; 2007 May; 111(18):3642-51. PubMed ID: 17432836
[TBL] [Abstract][Full Text] [Related]
37. Structural rearrangements and magic numbers in reactions between pyridine-containing water clusters and ammonia.
Ryding MJ; Ruusuvuori K; Andersson PU; Zatula AS; McGrath MJ; Kurtén T; Ortega IK; Vehkamäki H; Uggerud E
J Phys Chem A; 2012 May; 116(20):4902-8. PubMed ID: 22559268
[TBL] [Abstract][Full Text] [Related]
38. Structures and infrared spectra of fluoride-hydrogen sulfide clusters from ab initio calculations: F(-)-(H2S)n, n = 1-5.
Wild DA; Lenzer T
Phys Chem Chem Phys; 2005 Nov; 7(22):3793-804. PubMed ID: 16358028
[TBL] [Abstract][Full Text] [Related]
39. Distinctive IR signature of CO(3)(*-) and CO(3)(2-) hydrated clusters: a theoretical study.
Pathak AK; Maity DK
J Phys Chem A; 2009 Dec; 113(48):13443-7. PubMed ID: 19886648
[TBL] [Abstract][Full Text] [Related]
40. Proton transfer of NH3-HCl catalyzed by only one molecule.
Li RJ; Li ZR; Wu D; Chen W; Li Y; Wang BQ; Sun CC
J Phys Chem A; 2005 Feb; 109(4):629-34. PubMed ID: 16833389
[TBL] [Abstract][Full Text] [Related]
[Previous] [Next] [New Search]
