349 related articles for article (PubMed ID: 15634060)
1. HF(H2O)n clusters with an excess electron: ab initio study.
Odde S; Mhin BJ; Lee HM; Kim KS
J Chem Phys; 2004 Dec; 121(22):11083-7. PubMed ID: 15634060
[TBL] [Abstract][Full Text] [Related]
2. Accurate ab initio binding energies of alkaline earth metal clusters.
Lee JS
J Phys Chem A; 2005 Dec; 109(51):11927-32. PubMed ID: 16366644
[TBL] [Abstract][Full Text] [Related]
3. Accuracy and limitations of second-order many-body perturbation theory for predicting vertical detachment energies of solvated-electron clusters.
Herbert JM; Head-Gordon M
Phys Chem Chem Phys; 2006 Jan; 8(1):68-78. PubMed ID: 16482246
[TBL] [Abstract][Full Text] [Related]
4. Isomers of the uracil dimer: an ab initio benchmark study.
Frey JA; Müller A; Losada M; Leutwyler S
J Phys Chem B; 2007 Apr; 111(13):3534-42. PubMed ID: 17388514
[TBL] [Abstract][Full Text] [Related]
5. Electron affinity of Al13: a correlated electronic structure study.
Smith QA; Gordon MS
J Phys Chem A; 2011 Feb; 115(5):899-903. PubMed ID: 21218839
[TBL] [Abstract][Full Text] [Related]
6. An ab initio correlated study of the potential energy surface for the HOBr.H2O complex.
Santos CM; Faria R; Machado SP; De Almeida WB
J Chem Phys; 2004 Jul; 121(1):141-8. PubMed ID: 15260531
[TBL] [Abstract][Full Text] [Related]
7. An ab initio benchmark study of hydrogen bonded formamide dimers.
Frey JA; Leutwyler S
J Phys Chem A; 2006 Nov; 110(45):12512-8. PubMed ID: 17091957
[TBL] [Abstract][Full Text] [Related]
8. 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]
9. Structures, energetics, vibrational spectra of NH4+ (H2O)(n=4,6) clusters: Ab initio calculations and first principles molecular dynamics simulations.
Karthikeyan S; Singh JN; Park M; Kumar R; Kim KS
J Chem Phys; 2008 Jun; 128(24):244304. PubMed ID: 18601329
[TBL] [Abstract][Full Text] [Related]
10. Symmetric and asymmetric triple excitation corrections for the orbital-optimized coupled-cluster doubles method: improving upon CCSD(T) and CCSD(T)(Λ): preliminary application.
Bozkaya U; Schaefer HF
J Chem Phys; 2012 May; 136(20):204114. PubMed ID: 22667547
[TBL] [Abstract][Full Text] [Related]
11. Improved supermolecular second order Møller-Plesset intermolecular interaction energies using time-dependent density functional response theory.
Hesselmann A
J Chem Phys; 2008 Apr; 128(14):144112. PubMed ID: 18412428
[TBL] [Abstract][Full Text] [Related]
12. Basis set and electron correlation effects on the polarizability and second hyperpolarizability of model open-shell pi-conjugated systems.
Champagne B; Botek E; Nakano M; Nitta T; Yamaguchi K
J Chem Phys; 2005 Mar; 122(11):114315. PubMed ID: 15839724
[TBL] [Abstract][Full Text] [Related]
13. Quantitative prediction of gas-phase (15)N and (31)P nuclear magnetic shielding constants.
Prochnow E; Auer AA
J Chem Phys; 2010 Feb; 132(6):064109. PubMed ID: 20151735
[TBL] [Abstract][Full Text] [Related]
14. Coupled-cluster and explicitly correlated perturbation-theory calculations of the uracil anion.
Bachorz RA; Klopper W; Gutowski M
J Chem Phys; 2007 Feb; 126(8):085101. PubMed ID: 17343472
[TBL] [Abstract][Full Text] [Related]
15. Electron solvation in water-ammonia mixed clusters: Structure, energetics, and the nature of localization states of the excess electron.
Pratihar S; Chandra A
J Chem Phys; 2007 Jun; 126(23):234510. PubMed ID: 17600428
[TBL] [Abstract][Full Text] [Related]
16. Simple coupled-cluster singles and doubles method with perturbative inclusion of triples and explicitly correlated geminals: The CCSD(T)R12 model.
Valeev EF; Daniel Crawford T
J Chem Phys; 2008 Jun; 128(24):244113. PubMed ID: 18601323
[TBL] [Abstract][Full Text] [Related]
17. Structures, energetics, and vibrational spectra of H2O2...(H2O)n, n = 1-6 clusters: Ab initio quantum chemical investigations.
Kulkarni AD; Pathak RK; Bartolotti LJ
J Phys Chem A; 2005 May; 109(20):4583-90. PubMed ID: 16833795
[TBL] [Abstract][Full Text] [Related]
18. Negative ions of nitroethane and its clusters.
Stokes ST; Bowen KH; Sommerfeld T; Ard S; Mirsaleh-Kohan N; Steill JD; Compton RN
J Chem Phys; 2008 Aug; 129(6):064308. PubMed ID: 18715070
[TBL] [Abstract][Full Text] [Related]
19. Stepwise hydration of the cyanide anion: a temperature-controlled photoelectron spectroscopy and ab initio computational study of CN-(H2O)n, n=2-5.
Wang XB; Kowalski K; Wang LS; Xantheas SS
J Chem Phys; 2010 Mar; 132(12):124306. PubMed ID: 20370122
[TBL] [Abstract][Full Text] [Related]
20. Excess electrons bound to small ammonia clusters.
Sommerfeld T
J Phys Chem A; 2008 Nov; 112(46):11817-23. PubMed ID: 18954033
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]
