Lista de obras -

4d and 5d bimetal doped tubular silicon clusters Si12M2 with M = Nb, Ta, Mo and W: a bimetallic configuration model.

artículo científico publicado en 2017

Advances in Synthesis of π-Extended Benzosilole Derivatives and Their Analogs

scientific article published on 27 January 2020

Another Look at Photoelectron Spectra of the Anion Cr2O2-: Multireference Character and Energetic Degeneracy

scientific article published on 07 August 2018

Aromaticity of Some Metal Clusters: A Different View from Magnetic Ring Current.

artículo científico publicado en 2018

Autocatalysis in Formose Reaction and Formation of RNA Nucleosides

scientific article published on 03 December 2020

Boosting Li-Ion Transport in Transition-Metal-Doped Li2SnO3

artículo científico publicado en 2020

Boron Teetotum: Metallic [Ti(B6C xN y)] q and Bimetallic [Ti2(B6C xN y)] q Nine-Membered Heterocycles with x + y = 3 and -1 ≤ q ≤ 3

artículo científico publicado en 2018

Comment on "Theoretical Investigations on Geometrical and Electronic Structures of Silver Clusters"

scientific article published on 07 May 2019

Effects of Charge Transfer on the Adsorption of CO on Small Molybdenum-Doped Platinum Clusters.

artículo científico publicado en 2017

Elucidating the binding mechanism of thione-containing mercaptopurine and thioguanine drugs to small gold clusters

artículo científico publicado en 2020

Formation of a bi-rhodium boron tube Rh2B18 and its great CO2 capture ability

scientific article published on 16 August 2018

Formation of the M2B18q Teetotum Boron Clusters with 4d and 5d Transition Metals M = Rh, Pd, Ir, and Pt

scientific article published on 16 September 2019

Impact of the Astaxanthin, Betanin, and EGCG Compounds on Small Oligomers of Amyloid Aβ40 Peptide

artículo científico publicado en 2020

Insights into Geometric and Electronic Structures of VGe3-/0 Clusters from Anion Photoelectron Spectrum Assignment

artículo científico publicado en 2017

Insights into the cooperativity between multiple interactions of dimethyl sulfoxide with carbon dioxide and water

artículo científico publicado en 2018

Mechanistic Study on Water Splitting Reactions by Small Silicon Clusters Si3X, X = Si, Be, Mg, Ca

artículo científico publicado en 2018

Molecular details of spontaneous insertion and interaction of HCV non-structure 3 protease protein domain with PIP2-containing membrane.

artículo científico publicado en 2018

Origin of the bright photoluminescence of few-atom silver clusters confined in LTA zeolites

artículo científico publicado en 2018

Reaction Routes for Experimentally Observed Intermediates in the Prebiotic Formation of Nucleobases under High-Temperature Conditions.

artículo científico publicado en 2018

Structural Evolution and Stability Trend of Small-Sized Gold Clusters Aun (n = 20-30)

scientific article published on 07 February 2020

Structural Investigation of Human Prolactin Receptor Transmembrane Domain Homodimerization in a Membrane Environment through Multiscale Simulations

scientific article published on 30 May 2019

Structural assignment of small cationic silver clusters by far-infrared spectroscopy and DFT calculations

artículo científico publicado en 2017

Structure and stability of aluminium doped lithium clusters (LinAl0/+, n = 1–8): a case of the phenomenological shell model ⬇️

artículo científico publicado el 2 de agosto de 2010

Structure, stability and bonding of the leapfrog B24 0 ,±1,±2

artículo científico publicado en 2020

Structures, stabilities and aromatic properties of endohedrally transition metal doped boron clusters M@B22, M = Sc and Ti: a theoretical study

artículo científico publicado en 2020

The teetotum cluster Li2FeB14 and its possible use for constructing boron nanowires

artículo científico publicado en 2020

Theoretical Investigation of Metallic Heterofullerenes of Silicon and Germanium Mixed with Phosphorus and Arsenic Atoms M-A8E6, A = Si, Ge; E = P, As; and M = Cr, Mo, W.

artículo científico publicado en 2017

Theoretical Study of Silicon Monoxide Reactions with Ammonia and Methane

artículo científico publicado en 2017

Theoretical study on the interaction of iodide electrolyte/organic dye with the TiO2 surface in dye-sensitized solar cells

artículo científico publicado en 2020

Titanium Digermanium: Theoretical Assignment of Electronic Transitions Underlying Its Anion Photoelectron Spectrum

artículo científico publicado en 2017

Lista de obras de

4d and 5d bimetal doped tubular silicon clusters Si12M2 with M = Nb, Ta, Mo and W: a bimetallic configuration model.

Advances in Synthesis of π-Extended Benzosilole Derivatives and Their Analogs

Another Look at Photoelectron Spectra of the Anion Cr2O2-: Multireference Character and Energetic Degeneracy

Aromaticity of Some Metal Clusters: A Different View from Magnetic Ring Current.

Autocatalysis in Formose Reaction and Formation of RNA Nucleosides

Boosting Li-Ion Transport in Transition-Metal-Doped Li2SnO3

Boron Teetotum: Metallic [Ti(B6C xN y)] q and Bimetallic [Ti2(B6C xN y)] q Nine-Membered Heterocycles with x + y = 3 and -1 ≤ q ≤ 3

Comment on "Theoretical Investigations on Geometrical and Electronic Structures of Silver Clusters"

Effects of Charge Transfer on the Adsorption of CO on Small Molybdenum-Doped Platinum Clusters.

Elucidating the binding mechanism of thione-containing mercaptopurine and thioguanine drugs to small gold clusters

Formation of a bi-rhodium boron tube Rh2B18 and its great CO2 capture ability

Formation of the M2B18q Teetotum Boron Clusters with 4d and 5d Transition Metals M = Rh, Pd, Ir, and Pt

Impact of the Astaxanthin, Betanin, and EGCG Compounds on Small Oligomers of Amyloid Aβ40 Peptide

Insights into Geometric and Electronic Structures of VGe3-/0 Clusters from Anion Photoelectron Spectrum Assignment

Insights into the cooperativity between multiple interactions of dimethyl sulfoxide with carbon dioxide and water

Mechanistic Study on Water Splitting Reactions by Small Silicon Clusters Si3X, X = Si, Be, Mg, Ca

Molecular details of spontaneous insertion and interaction of HCV non-structure 3 protease protein domain with PIP2-containing membrane.

Origin of the bright photoluminescence of few-atom silver clusters confined in LTA zeolites

Reaction Routes for Experimentally Observed Intermediates in the Prebiotic Formation of Nucleobases under High-Temperature Conditions.

Structural Evolution and Stability Trend of Small-Sized Gold Clusters Aun (n = 20-30)

Structural Investigation of Human Prolactin Receptor Transmembrane Domain Homodimerization in a Membrane Environment through Multiscale Simulations

Structural assignment of small cationic silver clusters by far-infrared spectroscopy and DFT calculations

Structure and stability of aluminium doped lithium clusters (LinAl0/+, n = 1–8): a case of the phenomenological shell model ⬇️

Structure, stability and bonding of the leapfrog B24 0 ,±1,±2

Structures, stabilities and aromatic properties of endohedrally transition metal doped boron clusters M@B22, M = Sc and Ti: a theoretical study

The teetotum cluster Li2FeB14 and its possible use for constructing boron nanowires

Theoretical Investigation of Metallic Heterofullerenes of Silicon and Germanium Mixed with Phosphorus and Arsenic Atoms M-A8E6, A = Si, Ge; E = P, As; and M = Cr, Mo, W.

Theoretical Study of Silicon Monoxide Reactions with Ammonia and Methane

Theoretical study on the interaction of iodide electrolyte/organic dye with the TiO2 surface in dye-sensitized solar cells

Titanium Digermanium: Theoretical Assignment of Electronic Transitions Underlying Its Anion Photoelectron Spectrum