Alvaro Muñoz-Castro

All papers authored by Alvaro Muñoz-Castro

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2023 Rafael Lingas, Nickolas D. Charistos

, Alvaro Muñoz-Castro

Local and global aromaticity under rotation: analysis of two- and three-dimensional representative carbon nanostructures

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2022 Mesías Orozco-Ic

, Nickolas D. Charistos

, Alvaro Muñoz-Castro

, Rafael Islas, Dage Sundholm

, Gabriel Merino

Core-electron contributions to the molecular magnetic response

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2020 Renato Pereira Orenha

, Nelson Henrique Morgon, Julia Contreras-García, Graziele Cappato Guerra Silva, Glaucio Régis Nagurniak

, Maurício Jeomar Piotrowski

, Giovanni Finoto Caramori

, Alvaro Muñoz-Castro

, Renato Luis Tame Parreira

How does the acidic milieu interfere in the capability of ruthenium nitrosyl complexes to release nitric oxide?

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Nickolas D. Charistos

, Alvaro Muñoz-Castro

Induced magnetic field in sp-hybridized carbon rings: analysis of double aromaticity and antiaromaticity in cyclo[2N]carbon allotropes

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2019 Cristian Linares‐Flores

, Rodrigo Ramirez‐Tagle

, Macarena Rojas‐Poblete

, Ramiro Arratia‐Perez

, Alvaro Muñoz‐Castro

, Raul Guajardo‐Maturana

Role of donor‐acceptor functional groups in N 3 P 3 cyclic‐triphosphazene backbone. Unraveling bonding characteristics from natural orbitals within an extended transition state‐natural orbital for the chemical valence scheme

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Franck Gam, Ramiro Arratia‐Pérez

, Samia Kahlal, Jean‐Yves Saillard

, Alvaro Muñoz‐Castro

Stabilizing heteroatom‐centered 16‐vertex group 11 tetrahedral architectures: Bonding and structural considerations toward versatile endohedral species

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Nickolas D. Charistos

, Peng Jin

, Alvaro Muñoz‐Castro

Aromatic character of O_h‐C₂₄N₂₄. A cavernous nitride fullerene bearing N₄‐macrocycle motifs

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Nickolas D. Charistos

, Alvaro Muñoz-Castro

, Michael P. Sigalas

The pseudo-π model of the induced magnetic field: fast and accurate visualization of shielding and deshielding cones in planar conjugated hydrocarbons and spherical fullerenes

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Nickolas D. Charistos

, Alvaro Muñoz-Castro

Double aromaticity of the B40 fullerene: induced magnetic field analysis of π and σ delocalization in the boron cavernous structure

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Franck Gam, Ramiro Arratia-Perez

, Samia Kahlal, Jean-Yves Saillard, Alvaro Muñoz-Castro

Potential to stabilize 16-vertex tetrahedral coinage-metal cluster architectures related to Au20

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2018 Alexandre O. Ortolan, Nicholas D. Charistos

, Raul Guajardo‐Maturana, Carolina Olea Ulloa, Giovanni F. Caramori

, Renato L. T. Parreira, Alvaro Muñoz‐Castro

On the cation–π capabilities of small all sp²‐carbon host structures. Evaluation of [6.8]₃cyclacene from relativistic DFT calculations

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Nickolas D. Charistos

, Alvaro Muñoz-Castro

Induced Magnetic Field of Fullerenes: Role of σ- and π- Contributions to Spherical Aromatic, Nonaromatic, and Antiaromatic Character in C60q (q = +10, 0, −6, −12), and Related Alkali-Metal Decorated Building Blocks, Li12C60 and Na6C60

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Francisca Claveria-Cadiz

, Ramiro Arratia-Perez

, Raúl Guajardo-Maturana

, Alvaro Muñoz-Castro

Survey of short and long cuprophilic d10–d10 contacts for tetranuclear copper clusters. Understanding of bonding and ligand role from a planar superatom perspective

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2017 Nickolas D. Charistos

, Anastasios G. Papadopoulos, Thomas A. Nikopoulos, Alvaro Muñoz-Castro

, Michael P. Sigalas

Canonical orbital contributions to the magnetic fields induced by global and local diatropic and paratropic ring currents

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A. G. Papadopoulos, N. D. Charistos

, A. Muñoz-Castro

Magnetic Response of Aromatic Rings Under Rotation: Aromatic Shielding Cone of Benzene Upon Different Orientations of the Magnetic Field

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Alvaro Muñoz-Castro

, Ivan A. Popov

, Alexander I. Boldyrev

Long-range magnetic response of toroidal boron structures: B16and [Co@B16]−/3−species

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All papers authored by Alvaro Muñoz-Castro