Detalhe da pesquisa
1.
Aromatic and magnetic properties in a series of heavy rare earth-doped Ge6 cluster anions.
J Comput Chem
; 45(14): 1087-1097, 2024 May 30.
Artigo
Inglês
| MEDLINE | ID: mdl-38243618
2.
Exploring the stability and aromaticity of rare earth doped tin cluster MSn16- (M = Sc, Y, La).
Phys Chem Chem Phys
; 26(4): 2986-2994, 2024 Jan 24.
Artigo
Inglês
| MEDLINE | ID: mdl-38163990
3.
Investigation of Structures, Stabilities, and Electronic and Magnetic Properties of Niobium Carbon Clusters Nb7Cn (n = 1-7).
Molecules
; 29(8)2024 Apr 09.
Artigo
Inglês
| MEDLINE | ID: mdl-38675512
4.
Making Sense of the Growth Behavior of Ultra-High Magnetic Gd2-Doped Silicon Clusters.
Molecules
; 28(13)2023 Jun 28.
Artigo
Inglês
| MEDLINE | ID: mdl-37446733
5.
A joint experimental and theoretical study on structural, electronic, and magnetic properties of MnGen - (n = 3-14) clusters.
J Chem Phys
; 154(20): 204302, 2021 May 28.
Artigo
Inglês
| MEDLINE | ID: mdl-34241172
6.
Structural and electronic properties of exohedrally doped neutral silicon clusters LnSin (n = 5, 10; Ln = Sm, Eu, Yb).
Phys Chem Chem Phys
; 22(36): 20545-20552, 2020 Sep 23.
Artigo
Inglês
| MEDLINE | ID: mdl-32966449
7.
Probing the stability of neutral and anionic transition-metal-doped golden cage nanoclusters: M@Au16 (M = Sc, Ti, V).
Phys Chem Chem Phys
; 16(1): 244-54, 2014 Jan 07.
Artigo
Inglês
| MEDLINE | ID: mdl-24247727
8.
Probing the structural and electronic properties of small vanadium monoxide clusters.
Phys Chem Chem Phys
; 14(15): 5272-83, 2012 Apr 21.
Artigo
Inglês
| MEDLINE | ID: mdl-22402784
9.
Probing the structural and electronic properties of small vanadium dioxide clusters by density functional theory and comparison with experimental photoelectron spectroscopy.
J Chem Phys
; 137(16): 164304, 2012 Oct 28.
Artigo
Inglês
| MEDLINE | ID: mdl-23126707
10.
Microsolvation of Co- in water: Density functional theory calculations coupled with stochastic kicking method.
Spectrochim Acta A Mol Biomol Spectrosc
; 245: 118935, 2021 Jan 15.
Artigo
Inglês
| MEDLINE | ID: mdl-32971345
11.
Density functional study of structural and electronic properties of bimetallic copper-gold clusters: comparison with pure and doped gold clusters.
Phys Chem Chem Phys
; 12(19): 5156-65, 2010 May 21.
Artigo
Inglês
| MEDLINE | ID: mdl-20358129
12.
Probing the structural, electronic, and adsorptive properties of Au16O2- clusters.
J Mol Model
; 26(12): 337, 2020 Nov 10.
Artigo
Inglês
| MEDLINE | ID: mdl-33169289
13.
Structural, electronic, and magnetic properties of gold cluster anions doped with zinc: Au(n)Zn- (2 < or = n < or = 10).
J Phys Chem A
; 113(51): 14022-8, 2009 Dec 24.
Artigo
Inglês
| MEDLINE | ID: mdl-19874045
14.
The stability, electronic, and magnetic properties of rare-earth doped silicon-based clusters.
J Mol Model
; 25(8): 221, 2019 Jul 13.
Artigo
Inglês
| MEDLINE | ID: mdl-31302782
15.
Stabilization of golden cages by encapsulation of a single transition metal atom.
R Soc Open Sci
; 5(1): 171019, 2018 Jan.
Artigo
Inglês
| MEDLINE | ID: mdl-29410813
16.
Structural, electronic and magnetic effects of Al-doped niobium clusters: a density functional theory study.
J Mol Model
; 18(7): 2993-3001, 2012 Jul.
Artigo
Inglês
| MEDLINE | ID: mdl-22146984
17.
Probing the structural and magnetic properties of transition metal-benzene anion complexes.
Dalton Trans
; 40(17): 4578-89, 2011 May 07.
Artigo
Inglês
| MEDLINE | ID: mdl-21437303