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SciProfiles: 1475194
Scopus Author ID: 57208507416

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Works (21)

Thermodynamics and kinetics of early stages of carbon dot formation: a case of citric acid and ethylenediamine reaction

Nanoscale
2025 | Journal article
DOI: 10.1039/d4nr04420g
Part of ISSN: 2040-3364
Part of ISSN: 2040-3372
Contributors: Martin Pykal; Jela Nociarová; David Reha; Juraj Filo; Marek Sebela; Petr Zajíček; Markéta Paloncýová; Chiara Olla; Francesca Mocci; Antonio Cappai et al.
Source: Self-asserted source
Antonio CAPPAI

Graphene quantum dots and carbon nanodots: modeling of zero-dimensional carbon nanomaterials

Zero-Dimensional Carbon Nanomaterials
2024 | Book chapter
DOI: 10.1016/b978-0-323-99535-1.00014-7
Part of ISBN: 9780323995351
Contributors: Carlo Maria Carbonaro; Leon Engelbrecht; Chiara Olla; Antonio Cappai; Maria, Francesca Casula; Claudio Melis; Luigi Stagi; Aatto Laaksonen; Francesca Mocci
Source: Self-asserted source
Antonio CAPPAI

Manipulating molecular orientation in vapor-deposited organic semiconductor glasses <i>via in situ</i> electric fields: a molecular dynamics study

Journal of Materials Chemistry C
2024 | Journal article
DOI: 10.1039/d4tc03271c
Part of ISSN: 2050-7526
Part of ISSN: 2050-7534
Contributors: Marta Rodríguez-López; Marta Gonzalez Silveira; Antonio Cappai; Riccardo Dettori; Cristian Rodríguez Tinoco; CLAUDIO MELIS; Luciano Colombo; Javier Rodriguez-Viejo
Source: Self-asserted source
Antonio CAPPAI

Molecular Dynamics Simulations of Thermal Transport in Solid State Systems

Comprehensive Computational Chemistry
2024 | Book chapter
DOI: 10.1016/b978-0-12-821978-2.00095-7
Part of ISBN: 9780128232569
Contributors: Antonio Cappai; Claudio Melis; Luciano Colombo; Riccardo Dettori
Source: Self-asserted source
Antonio CAPPAI

Slow magnetic relaxation in a heteroleptic anilate-based Dy<sup>III</sup> metal–organic framework

Dalton Transactions
2024 | Journal article
DOI: 10.1039/d4dt01979b
Part of ISSN: 1477-9226
Part of ISSN: 1477-9234
Contributors: Mariangela Oggianu; Federica Bertolotti; Fabio Manna; FRANCESCO CONGIU; Antonio Cappai; CLAUDIO MELIS; Giorgio Concas; Narcis Avarvari; Norberto Masciocchi; MARIA LAURA MERCURI
Source: Self-asserted source
Antonio CAPPAI

An Ab Initio Investigation of Ultra‐Low Thermal Conductivity in Organically Functionalized TaS2${\rm TaS}_2$

Advanced Theory and Simulations
2024-06 | Journal article
DOI: 10.1002/adts.202400056
Contributors: Francesco Siddi; Antonio Cappai; Luciano Colombo; Claudio Melis
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Modeling the Coupled Mass‐Heat Transport in Lennard–Jones‐Like Binary Mixtures by Approach‐to‐Equilibrium Molecular Dynamics

Advanced Theory and Simulations
2024-04 | Journal article
DOI: 10.1002/adts.202300849
Contributors: Antonio Cappai; Luciano Colombo; Claudio Melis
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Strong Anharmonicity at the Origin of Anomalous Thermal Conductivity in Double Perovskite Cs2NaYbCl6

Advanced Science
2024-03 | Journal article
DOI: 10.1002/advs.202305861
Contributors: Antonio Cappai; Claudio Melis; Daniela Marongiu; Francesco Quochi; Michele Saba; Francesco Congiu; Yihui He; Tyler J. Slade; Mercouri G. Kanatzidis; Luciano Colombo
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Introducing the concept of generalized thermal diffusivity to understand coupled heat–charge transport in ionic solutions

Applied Physics Letters
2024-03-18 | Journal article
DOI: 10.1063/5.0201444
Contributors: Antonio Cappai; Riccardo Dettori; Federica Marini; Claudio Melis; Luciano Colombo
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Phosphorescence by trapping defects in boric acid induced by thermal processing

arXiv
2023 | Other
DOI: 10.48550/arXiv.2311.04821
EID:

2-s2.0-85178435830

Part of ISSN: 23318422
Contributors: Stagi, L.; Malfatti, L.; Zollo, A.; Livraghi, S.; Carboni, D.; Chiriu, D.; Corpino, R.; Ricci, P.C.; Cappai, A.; Carbonaro, C.M. et al.
Source: Self-asserted source
Antonio CAPPAI via Scopus - Elsevier

Phosphorescence by Trapping Defects in Boric Acid Induced by Thermal Processing

Advanced Optical Materials
2023 | Journal article
DOI: 10.1002/adom.202302682
EID:

2-s2.0-85178140620

Part of ISSN: 21951071
Contributors: Stagi, L.; Malfatti, L.; Zollo, A.; Livraghi, S.; Carboni, D.; Chiriu, D.; Corpino, R.; Ricci, P.C.; Cappai, A.; Carbonaro, C.M. et al.
Source: Self-asserted source
Antonio CAPPAI via Scopus - Elsevier

Selecting molecular or surface centers in carbon dots-silica hybrids to tune the optical emission: A photo-physics study down to the atomistic level

Journal of Colloid and Interface Science
2023 | Journal article
DOI: 10.1016/j.jcis.2022.12.023
EID:

2-s2.0-85144466152

Part of ISSN: 10957103 00219797
Contributors: Olla, C.; Ricci, P.C.; Chiriu, D.; Fantauzzi, M.; Casula, M.F.; Mocci, F.; Cappai, A.; Porcu, S.; Stagi, L.; Carbonaro, C.M.
Source: Self-asserted source
Antonio CAPPAI via Scopus - Elsevier
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Understanding coupled mass-heat transport in fluids by approach-to-equilibrium molecular dynamics

arXiv
2023 | Other
DOI: 10.48550/arXiv.2308.16169
EID:

2-s2.0-85171636732

Part of ISSN: 23318422
Contributors: Cappai, A.; Colombo, L.; Melis, C.
Source: Self-asserted source
Antonio CAPPAI via Scopus - Elsevier

Exploring the Impact of Nitrogen Doping on the Optical Properties of Carbon Dots Synthesized from Citric Acid

Nanomaterials
2023-04-12 | Journal article
DOI: 10.3390/nano13081344
Contributors: Chiara Olla; Antonio Cappai; Stefania Porcu; Luigi Stagi; Marzia Fantauzzi; Maria Francesca Casula; Francesca Mocci; Riccardo Corpino; Daniele Chiriu; Pier Carlo Ricci et al.
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Carbon Nanodots from an In Silico Perspective

Chemical Reviews
2022-08-24 | Journal article
DOI: 10.1021/acs.chemrev.1c00864
Contributors: Francesca Mocci; Leon de Villiers Engelbrecht; Chiara Olla; Antonio Cappai; Maria Francesca Casula; Claudio Melis; Luigi Stagi; Aatto Laaksonen; Carlo Maria Carbonaro
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Formation of citrazinic acid ions and their contribution to optical and magnetic features of carbon nanodots: A combined experimental and computational approach

Materials
2021 | Journal article
DOI: 10.3390/ma14040770
EID:

2-s2.0-85100727167

Part of ISSN: 19961944
Contributors: Mocci, F.; Olla, C.; Cappai, A.; Corpino, R.; Ricci, P.C.; Chiriu, D.; Salis, M.; Carbonaro, C.M.
Source: Self-asserted source
Antonio CAPPAI via Scopus - Elsevier
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Insight into the Molecular Model in Carbon Dots through Experimental and Theoretical Analysis of Citrazinic Acid in Aqueous Solution

The Journal of Physical Chemistry C
2021-03-04 | Journal article
DOI: 10.1021/acs.jpcc.0c10916
Contributors: Antonio Cappai; Claudio Melis; Luigi Stagi; Pier C. Ricci; Francesca Mocci; Carlo M. Carbonaro
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Atomistic investigation of conjugated polymers for thermoelectric applications: from morphology to transport properties

2021-02-09 | Dissertation or Thesis | Writing - original draft, Writing - review & editing, Conceptualization, Formal analysis, Methodology, Data curation
Contributors: Antonio CAPPAI
Source: Self-asserted source
Antonio CAPPAI

Impact of synthetic conditions on the anisotropic thermal conductivity of poly(3,4-ethylenedioxythiophene) (PEDOT): A molecular dynamics investigation

Physical Review Materials
2020-03-05 | Journal article
DOI: 10.1103/PhysRevMaterials.4.035401
Contributors: Antonio Cappai; Aleandro Antidormi; Andrea Bosin; Dario Narducci; Luciano Colombo; Claudio Melis
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Interplay between synthetic conditions and micromorphology in poly(3,4-ethylenedioxythiophene):tosylate (PEDOT:Tos): an atomistic investigation

Physical Chemistry Chemical Physics
2019 | Journal article
DOI: 10.1039/C9CP00970A
Contributors: A. Cappai; A. Antidormi; A. Bosin; D. Galliani; D. Narducci; C. Melis
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Driving the polymerization of PEDOT:PSS by means of a nanoporous template: Effects on the structure

Polymer
2019-12 | Journal article
DOI: 10.1016/j.polymer.2019.121941
Contributors: Andrea Pinna; Maria Francesca Casula; Luca Pilia; Antonio Cappai; Claudio Melis; Pier Carlo Ricci; Carlo Maria Carbonaro
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Peer review (7 reviews for 1 publication/grant)

Review activity for The European physical journal plus. (7)
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