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Chigo Anota, Ernesto
90  Ergebnisse:
Personensuche X
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1

Exploring the potential use of pristine and metal-encapsula..:

Gholami, Aref ; Shakerzadeh, Ehsan ; Chigo Anota, Ernesto
Polyhedron.  232 (2023)  - p. 116295 , 2023
Link: https://doi.org/10.1016/..
 
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2

A theoretical perspective on the adsorption performance of ..:

Gholami, Aref ; Shakerzadeh, Ehsan ; Chigo Anota, Ernesto.
Inorganic Chemistry Communications.  148 (2023)  - p. 110326 , 2023
Link: https://doi.org/10.1016/..
 
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3

Effect of global charge on stability and electronic propert..:

Salazar Villanueva, Martin ; Bautista Hernandez, Alejandro ; Shakerzadeh, Ehsan.
Physica E: Low-dimensional Systems and Nanostructures.  152 (2023)  - p. 115758 , 2023
Link: https://doi.org/10.1016/..
 
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4

Acetylsalicylic acid interaction with Boron nitride nanostr..:

Flores Bautista, Maria Corazon ; Cortés-Arriagada, Diego ; Shakerzadeh, Ehsan.
Journal of Molecular Liquids.  355 (2022)  - p. 118980 , 2022
Link: https://doi.org/10.1016/..
 
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5

Ibuprofen Photodegradation by Ag2O and Ag/Ag2O Composites U..:

Padilla Villavicencio, Montserrat ; Escobedo Morales, Alejandro ; Ruiz Peralta, Ma. de Lourdes...
Catalysis Letters.  150 (2020)  8 - p. 2385-2399 , 2020
Link: https://doi.org/10.1007/..
 
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6

Chemical and Physical Viewpoints About the Bonding in Fulle..:

Cortes-Arriagada, Diego ; Sanhueza, Luis ; Bautista-Hernandez, Alejandro..
The Journal of Physical Chemistry C.  123 (2019)  39 - p. 24209-24219 , 2019
Link: https://doi.org/10.1021/..
 
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7

Tuning the electronic‐optical properties of porphyrin‐like ..:

Shakerzadeh, Ehsan ; Tahmasebi, Elham ; Solimannejad, Mohammad.
Applied Organometallic Chemistry.  33 (2018)  1 - p. , 2018
Link: https://doi.org/10.1002/..
 
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8

Physicochemical properties of armchair non-stoichiometric b..:

Chigo Anota, Ernesto ; Salazar Villanueva, Martin ; García Toral, Dolores..
Superlattices and Microstructures.  89 (2016)  - p. 319-328 , 2016
Link: https://doi.org/10.1016/..
 
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9

GGA-based analysis of the metformin adsorption on BN nanotu..:

Chigo Anota, Ernesto ; Cocoletzi, Gregorio H.
Physica E: Low-dimensional Systems and Nanostructures.  56 (2014)  - p. 134-140 , 2014
Link: https://doi.org/10.1016/..
 
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10

First-principles simulations of the chemical functionalizat..:

Chigo Anota, Ernesto ; Cocoletzi, Gregorio H.
Journal of Molecular Modeling.  19 (2013)  6 - p. 2335-2341 , 2013
Link: https://doi.org/10.1007/..
 
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11

Electronic properties of functionalized (5,5) beryllium oxi..:

Chigo Anota, Ernesto ; Cocoletzi, Gregorio Hernández
Journal of Molecular Graphics and Modelling.  42 (2013)  - p. 115-119 , 2013
Link: https://doi.org/10.1016/..
 
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12

On the influence of point defects on the structural and ele..:

Chigo Anota, Ernesto ; Escobedo-Morales, Alejandro ; Salazar Villanueva, Martin..
Journal of Molecular Modeling.  19 (2012)  2 - p. 839-846 , 2012
Link: https://doi.org/10.1007/..
 
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13

Investigating the electronic properties of silicon nanoshee..:

Chigo Anota, Ernesto ; Bautista Hernández, Alejandro ; Castro, Miguel.
Journal of Molecular Modeling.  18 (2011)  5 - p. 2147-2152 , 2011
Link: https://doi.org/10.1007/..
 
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14

First principles calculations of the electronic and chemica..:

Hernández Rosas, J. J. ; Ramírez Gutiérrez, R. E. ; Escobedo-Morales, A..
Journal of Molecular Modeling.  17 (2010)  5 - p. 1133-1139 , 2010
Link: https://doi.org/10.1007/..
 
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15

A DFT study on the potential application of metal-encapsula..:

Shabavi, Zahra Mashak ; Shakerzadeh, Ehsan ; Yadav, Tarun...
Computational and Theoretical Chemistry.  1234 (2024)  - p. 114535 , 2024
Link: https://doi.org/10.1016/..
 
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