237 related articles for article (PubMed ID: 23039606)
1. Adsorption studies of C6H6 on Cu (111), Ag (111), and Au (111) within dispersion corrected density functional theory.
Chwee TS; Sullivan MB
J Chem Phys; 2012 Oct; 137(13):134703. PubMed ID: 23039606
[TBL] [Abstract][Full Text] [Related]
2. Density functional theory study of the adsorption of alkanethiols on Cu(111), Ag(111), and Au(111) in the low and high coverage regimes.
Cometto FP; Paredes-Olivera P; Macagno VA; Patrito EM
J Phys Chem B; 2005 Nov; 109(46):21737-48. PubMed ID: 16853824
[TBL] [Abstract][Full Text] [Related]
3. Ab initio studies of Ag-S bond formation during the adsorption of L-cysteine on Ag(111).
Luque NB; Santos E
Langmuir; 2012 Aug; 28(31):11472-80. PubMed ID: 22799749
[TBL] [Abstract][Full Text] [Related]
4. Biomolecular adsorption at aqueous silver interfaces: first-principles calculations, polarizable force-field simulations, and comparisons with gold.
Hughes ZE; Wright LB; Walsh TR
Langmuir; 2013 Oct; 29(43):13217-29. PubMed ID: 24079907
[TBL] [Abstract][Full Text] [Related]
5. Van der Waals interactions between hydrocarbon molecules and zeolites: periodic calculations at different levels of theory, from density functional theory to the random phase approximation and Møller-Plesset perturbation theory.
Göltl F; Grüneis A; Bučko T; Hafner J
J Chem Phys; 2012 Sep; 137(11):114111. PubMed ID: 22998253
[TBL] [Abstract][Full Text] [Related]
6. Adsorption of Benzene on Copper, Silver, and Gold Surfaces.
Bilić A; Reimers JR; Hush NS; Hoft RC; Ford MJ
J Chem Theory Comput; 2006 Jul; 2(4):1093-105. PubMed ID: 26633068
[TBL] [Abstract][Full Text] [Related]
7. Adsorption of small aromatic molecules on the (111) surfaces of noble metals: A density functional theory study with semiempirical corrections for dispersion effects.
Tonigold K; Gross A
J Chem Phys; 2010 Jun; 132(22):224701. PubMed ID: 20550410
[TBL] [Abstract][Full Text] [Related]
8. Molecular polarization bridging physical and chemical enhancements in surface enhanced Raman scattering.
Duan S; Xu X; Luo Y; Tian ZQ
Chem Commun (Camb); 2011 Nov; 47(41):11438-40. PubMed ID: 21935542
[TBL] [Abstract][Full Text] [Related]
9. Interactions of coinage metal clusters with histidine and their effects on histidine acidity; theoretical investigation.
Javan MJ; Jamshidi Z; Tehrani ZA; Fattahi A
Org Biomol Chem; 2012 Dec; 10(47):9373-82. PubMed ID: 23108513
[TBL] [Abstract][Full Text] [Related]
10. Structure, bonding, and linear optical properties of a series of silver and gold nanorod clusters: DFT/TDDFT studies.
Liao MS; Bonifassi P; Leszczynski J; Ray PC; Huang MJ; Watts JD
J Phys Chem A; 2010 Dec; 114(48):12701-8. PubMed ID: 21062075
[TBL] [Abstract][Full Text] [Related]
11. Dual-scale modeling of benzene adsorption onto Ni(111) and Au(111) surfaces in explicit water.
Schravendijk P; van der Vegt N; Delle Site L; Kremer K
Chemphyschem; 2005 Sep; 6(9):1866-71. PubMed ID: 16086342
[TBL] [Abstract][Full Text] [Related]
12. Potential-dependent studies on the interaction between phenylalanine-substituted bombesin fragments and roughened Ag, Au, and Cu electrode surfaces.
Podstawka E; Niaura G; Proniewicz LM
J Phys Chem B; 2010 Jan; 114(2):1010-29. PubMed ID: 20025214
[TBL] [Abstract][Full Text] [Related]
13. Adsorption of atoms on cu surfaces: a density functional theory study.
Pang XY; Xue LQ; Wang GC
Langmuir; 2007 Apr; 23(9):4910-7. PubMed ID: 17388612
[TBL] [Abstract][Full Text] [Related]
14. Trapping of BTX compounds by SiO2, Ag-SiO2, Cu-SiO2, and Fe-SiO2 porous substrates.
Hernández MA; Asomoza M; Rojas F; Solís S; Portillo R; Salgado MA; Felipe C; Portillo Y; Hernández F
Chemosphere; 2010 Nov; 81(7):876-83. PubMed ID: 20817219
[TBL] [Abstract][Full Text] [Related]
15. Density functional theory study of the carbonyl-ene reaction of encapsulated formaldehyde in Cu(I), Ag(I), and Au(I) exchanged FAU zeolites.
Wannakao S; Khongpracha P; Limtrakul J
J Phys Chem A; 2011 Nov; 115(45):12486-92. PubMed ID: 21942893
[TBL] [Abstract][Full Text] [Related]
16. Theoretical surface-enhanced Raman spectra study of substituted benzenes I. Density functional theoretical SERS modelling of benzene and benzonitrile.
Fleming GD; Golsio I; Aracena A; Celis F; Vera L; Koch R; Campos-Vallette M
Spectrochim Acta A Mol Biomol Spectrosc; 2008 Dec; 71(3):1049-55. PubMed ID: 18440856
[TBL] [Abstract][Full Text] [Related]
17. Equilibrium geometries, stabilities, and electronic properties of the bimetallic M2-doped Au(n) (M = Ag, Cu; n = 1-10) clusters: comparison with pure gold clusters.
Zhao YR; Kuang XY; Zheng BB; Li YF; Wang SJ
J Phys Chem A; 2011 Feb; 115(5):569-76. PubMed ID: 21192697
[TBL] [Abstract][Full Text] [Related]
18. Adsorption of benzene on noble metal surfaces studied by density functional theory with Van der Waals correction.
Toyoda K; Hamada I; Yanagisawa S; Morikawa Y
J Nanosci Nanotechnol; 2011 Apr; 11(4):2836-43. PubMed ID: 21776640
[TBL] [Abstract][Full Text] [Related]
19. Structure and bonding of isoleptic coinage metal (Cu, Ag, Au) dimethylaminonitrenes in the gas phase.
Fedorov A; Couzijn EP; Nagornova NS; Boyarkin OV; Rizzo TR; Chen P
J Am Chem Soc; 2010 Oct; 132(39):13789-98. PubMed ID: 20843043
[TBL] [Abstract][Full Text] [Related]
20. Substrate-mediated interactions and intermolecular forces between molecules adsorbed on surfaces.
Sykes EC; Han P; Kandel SA; Kelly KF; McCarty GS; Weiss PS
Acc Chem Res; 2003 Dec; 36(12):945-53. PubMed ID: 14674785
[TBL] [Abstract][Full Text] [Related]
[Next] [New Search]