2023

 

Número	Artigo	Qualis
1	DE SOUZA, MARCO ANTONIO ; SANTOS, ALEXANDRE ; DA SILVA, SEBASTIÃO WILLIAM ; BRAGA, JEZ WILLIAN ; SOUSA, MARCELO HENRIQUE . *e-mail: jez@unb.br Editor handled this article: Ivo M. Raimundo Jr. (Associate) Diffuse Reflectance FTIR of Latent Fingerprints and Discriminant Analysis for Sex Identification in Humans. JOURNAL OF THE BRAZILIAN CHEMICAL SOCIETY, v. 1, p. 1-7, 2023.	A2
2	MACHADO DE MACEDO, LUIZ GUILHERME ; NEGRÃO, CHARLES ALBERTO BRITO ; DE OLIVEIRA, RHUIAGO MENDES ; DE MENEZES, RAFAEL FERREIRA ; PIRANI, Fernando ; Gargano, Ricardo . The van der Waals interactions in systems involving superheavy elements: the case of oganesson ( Z = 118). PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v. 25, p. 633-645, 2023.	A1
3	DE LA TORRE PARI, S.A. ; AQUINO, J.C.R. ; CARLOS-CHILO, A.F. ; GUERRA, J.A. ; COAQUIRA, J.A.H. ; PACHECO-SALAZAR, D.G. ; Felix, J.F. ; SOLIS, J.L. ; ARAGÓN, F.F.H. . Enhancing the photoconductivity and gas sensing performance of TiO2/SnO2 heterostructures tuned by the thickness of the SnO2 upper layer. APPLIED SURFACE SCIENCE, v. 613, p. 156028, 2023.	A1
4	PEREIRA JÚNIOR, M.L.; DA CUNHA, W.F.; GIOZZA, W.F.; DE SOUSA JUNIOR, R.T.; RIBEIRO JUNIOR, L.A. Irida-Graphene: A New 2D Carbon Allotrope. Flatchem, v.x, p.100469 - x, 2023.	A1
5	GRIFFITH, M.A.R. ; RUFO, S. ; DIAS, ALEXANDRE C. ; DA SILVA, JUAREZ L.F. . Enhancing topological Weyl Semimetals by Janus transition-metal dichalcogenides structures. COMPUTATIONAL MATERIALS SCIENCE, v. 218, p. 112004, 2023.	A1

 

 

2022

 

Número	Artigo	Qualis
1	CASTRO, T.J. ; ARAGÓN, F.F.H. ; CONCEIÇÃO, E.J.F. ; COAQUIRA, J.A.H. ; MORAIS, P.C. ; DA SILVA, S.W. . Size controlling and tailoring the properties of Gd Zn1-O nanoparticles. CERAMICS INTERNATIONAL, v. 48, p. 4324-4331, 2022.	A1
2	Morais, Paulo C.; SILVA, DIEIME C. . Mathematical Modeling for an MTT Assay in Fluorine-Containing Graphene Quantum Dots. Nanomaterials, v. 12, p. 413-425, 2022.	A3
3	PINHEIRO, WILLIE OLIVEIRA ; COSTA DO SANTOS, MAYARA SIMONELLY ; FARIAS, GABRIEL RIBEIRO ; FASCINELI, MARIA LUIZA ; RAMOS, KHELLIDA LOIANE VIEIRA ; DUARTE, ELIZA CARLA BARROSO ; DAMASCENO, EMANUEL ADELINO MEDEIROS ; DA SILVA, JAQUELINE RODRIGUES ; JOANITTI, GRAZIELLA ANSELMO ; DE AZEVEDO, RICARDO BENTES ; SOUSA, MARCELO HENRIQUE ; LACAVA, ZULMIRA GUERRERO MARQUES ; MOSINIEWICZ-SZABLEWSKA, EWA ; SUCHOCKI, PIOTR ; MORAIS, PAULO CESAR ; DE ANDRADE, LAISE RODRIGUES . Combination of selol nanocapsules and magnetic hyperthermia hinders breast tumor growth in aged mice after a short-time treatment. NANOTECHNOLOGY, v. 33, p. 205101, 2022.	A1
4	ANDIA-HUARACHA, S. C. ; ZAPANA-CAYO, L. M. ; ARAGÓN, F. F. H. ; AQUINO, J. C. ROMERO ; COAQUIRA, J. A. H. ; GONZALES-LORENZO, C. D. ; AYALA-ARENAS, J. S. ; SOLIS, J. L. ; MORAIS, P. C. ; PACHECO-SALAZAR, D. G. . Tuning the photocatalytic activity of ZnO nanoparticles by the annihilation of intrinsic defects provoked by the thermal annealing. JOURNAL OF NANOPARTICLE RESEARCH, v. 24, p. 24-50, 2022.	A2
5	SIQUEIRA, ELIS REGINA LIMA ; PINHEIRO, WILLIE OLIVEIRA ; AQUINO, VICTOR RAUL ROMERO ; COELHO, BRENO CUNHA PINTO ; BAKUZIS, ANDRIS FIGUEIROA ; AZEVEDO, RICARDO BENTES ; SOUSA, MARCELO HENRIQUE ; MORAIS, PAULO CESAR . Engineering Gold Shelled Nanomagnets for Pre-Setting the Operating Temperature for Magnetic Hyperthermia. Nanomaterials, v. 12, p. 2760, 2022.	A3
6	DODONOV, A. V. ; Dodonov, V. V. . Dynamical Casimir effect via modulated Kerr or higher-order nonlinearities. PHYSICAL REVIEW A, v. 105, p. 013709, 2022.	A1
7	SOARES, C. E. K. ; DE LARA, L. S. ; DE CASTRO, A. S. M. ; Dodonov, V. V. . Entanglement and Squeezing in Dissipative Parametric Amplifier and Converter. JOURNAL OF RUSSIAN LASER RESEARCH, v. 43, p. 28-38, 2022.	B1
8	DODONOV, V.V.; HOROVITS, M.B. . Evolution of energy and magnetic moment of a quantum charged particle in power-decaying magnetic fields. PHYSICS LETTERS A, v. 441, p. 128161, 2022.	B1
9	Dodonov, V. V.; DODONOV, A. V. . Magnetic moment invariant Gaussian states of a charged particle in a homogeneous magnetic field. European Physical Journal Plus, v. 137, p. 575, 2022.	A2
10	Dodonov, V. V.; DODONOV, A. V. . Giant diamagnetism of a quantum charged particle after inversion of the magnetic field. PHYSICAL REVIEW A, v. 105, p. 062201, 2022.	A1
11	NOVAK, E. G. ; Oliveira, F. A. ; WIO, H. S. . Editorial: The Fluctuation-Dissipation Theorem Today. Frontiers in Physics, v. 10, p. 3389, 2022.	B1
12	GOMES-FILHO, MÁRCIO SAMPAIO ; Oliveira, Fernando Albuquerque ; BARBOSA, MARCO AURÉLIO ALVES . Modeling the diffusion-erosion crossover dynamics in drug release. PHYSICAL REVIEW E, v. 105, p. 044110, 2022.	A1
13	MOZO LUIS, EDWIN E ; DE ASSIS, THIAGO A ; OLIVEIRA, FERNANDO A . Unveiling the connection between the global roughness exponent and interface fractal dimension in EW and KPZ lattice models. JOURNAL OF STATISTICAL MECHANICS-THEORY AND EXPERIMENT, v. 2022, p. 083202, 2022.	A2
14	SOUZA, MARCO A. ; SANTOS, ALEXANDRE SILVA ; DA SILVA, SEBASTIÃO WILLIAM ; BRAGA, JEZ WILLIAN BATISTA ; SOUSA, MARCELO HENRIQUE . Raman spectroscopy of fingerprints and chemometric analysis for forensic sex determination in humans. FORENSIC CHEMISTRY, v. 27, p. 100395, 2022.	A1
15	SILVA, PATRICIA BENTO DA SILVA, JAQUELINE RODRIGUES DA RODRIGUES, MOSAR CORRÊA VIEIRA, JULIA AUGUSTO ANDRADE, IKARO ALVES DE NAGATA, TATSUYA SANTOS, ALEXANDRE SILVA SILVA, SEBASTIÃO WILLIAM DA ROCHA, MARCIA CRISTINA OLIVEIRA DA BÁO, SÔNIA NAIR MORAES-VIEIRA, PEDRO M. PROENÇA-MODENA, JOSÉ ANGELIM, MONARA K.C. DE SOUZA, GABRIELA FABIANO MURARO, STEFANIE PRIMON DE BARROS, ANDRÉ LUIS BRANCO DE SOUZA MARTINS, GLÊNDARA APARECIDA RIBEIRO-DIAS, FÁTIMA MACHADO, GIOVANNA FESSEL, MELISSA REGINA CHUDZINSKI-TAVASSI, ANA MARISA RONCONI, CÉLIA MACHADO GONÇALVES, DEBORA CURI, RUI OLIVEIRA, OSVALDO N. , AZEVEDO, RICARDO BENTES ; Detection of SARS-CoV-2 virus via dynamic light scattering using antibody-gold nanoparticle bioconjugates against viral spike protein. TALANTA, v. 243, p. 123355, 2022.	A1
16	PAZ-CORRALES, K. J. ; VILCA-HUAYHUA, C. ; ARAGÓN, FERMIN HERRERA ; VILLEGAS-LELOVSKY, LEONARDO ; COAQUIRA, JOSE A H ; da Silva, S W ; MARQUES, GILMAR EUGENIO ; TEODORO, MARCIO DALDIN ; PACHECO-SALAZAR, D. G. . Tuning intrinsic defects in ZnO films by controlling the vacuum annealing temperature: an experimental and theoretical approach. PHYSICA SCRIPTA, v. 1, p. 1, 2022.	A4
17	MELLO, VICTOR CARLOS ; ARAÚJO, VICTOR HUGO SOUSA ; DE PAIVA, KAREN LETYCIA RODRIGUES ; SIMÕES, MARINA MESQUITA ; MARQUES, DAFNE CAROLINE ; DA SILVA COSTA, NELICE ROBERTA ; DE SOUZA, ISADORA FLORÊNCIO ; DA SILVA, PATRICIA BENTO ; SANTOS, IGOR ; ALMEIDA, RAQUEL ; MAGALHÃES, KELLY GRACE ; DA SILVA, SEBASTIÃO WILLIAM ; SANTOS, ALEXANDRE SILVA ; VEIGA-SOUZA, FABIANE ; SOUZA, PAULO EDUARDO NARCIZO ; RADDICHI, MARINA ARANTES ; LONGO, JOÃO PAULO FIGUEIRÓ ; DE ARAÚJO, JENNIFER THAYANNE CAVALCANTE ; MUEHLMANN, LUIS ALEXANDRE ; CHORILLI, MARLUS ; BÁO, SÔNIA NAIR . Development of New Natural Lipid-Based Nanoparticles Loaded with Aluminum-Phthalocyanine for Photodynamic Therapy against Melanoma. Nanomaterials, v. 12, p. 3547, 2022.	A3
18	VASCONCELOS, RAILSON ; PAURA, EDSON N. C. ; MACHADO DE MACEDO, LUIZ GUILHERME ; Gargano, Ricardo . Magnetism and perfect spin filtering in pristine MgCl nanoribbons modulated by edge modification. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v. xx, p. xx, 2022.	A1
19	MENEZES, RAFAEL FERREIRA DE ; PIRANI, Fernando ; COLETTI, CECILIA ; MACEDO, LUIZ GUILHERME MACHADO DE ; Gargano, Ricardo . Functionalized graphene-based Quantum Dots: Promising adsorbents for CO, NO2, SO2, and NH3 Pollutant Gases. Materials Today Communications, v. 31, p. 103426, 2022.	A4
20	COSTA, CAIO VINÍCIUS SOUSA ; DE JESUS, GUILHERME CARLOS CARVALHO ; DE MACEDO, LUIZ GUILHERME MACHADO ; PIRANI, Fernando ; Gargano, Ricardo . A Detailed Study of Electronic and Dynamic Properties of Noble Gas-Oxygen Molecule Adducts. MOLECULES, v. 27, p. 7409-7420, 2022.	A2
21	CASSIANO, TIAGO DE SOUSA ARAÚJO ; DE SOUSA, LEONARDO EVARISTO ; RIBEIRO JUNIOR, LUIZ ANTÔNIO ; Silva, Geraldo Magela E ; de Oliveira Neto, Pedro Henrique . Charge transport in cove-type graphene nanoribbons: The role of quasiparticles. SYNTHETIC METALS, v. 287, p. 117056, 2022.	A1
22	CASSIANO, TIAGO DE SOUSA ARAÚJO ; de Oliveira Neto, Pedro Henrique ; E SILVA, GERALDO MAGELA . Quasiparticle dynamics by effective pi-field distortion. Scientific Reports, v. 12, p. 12:7967, 2022.	A1
23	DE SOUSA, MATHEUS S. M. ; LIU, FUJUN ; QU, FANYAO ; CHEN, WEI . Vacancy-engineered flat-band superconductivity in holey graphene. PHYSICAL REVIEW B, v. 105, p. 014511, 2022.	A1
24	LU, JIAJUN ; QU, FANYAO ; ZENG, HAO ; CAVALHEIRO DIAS, ALEXANDRE ; BRADÃO, DAVID S. ; REN, JUNFENG . Intrinsic Valley Splitting and Direct-to-Indirect Band Gap Transition in Monolayer HfZrSiCO. Journal of Physical Chemistry Letters, v. 13, p. 5204-5212, 2022.	A1
25	DE SOUSA, MATHEUS S. M. ; LIU, FUJUN ; MALARD, MARIANA ; QU, FANYAO ; CHEN, WEI . Symmetry-enforced nodal lines in the band structures of vacancy-engineered graphene. PHYSICAL REVIEW B, v. 105, p. 155414-1-155414-8, 2022.	A1
26	JIANG, XINXIN ; XIE, WENLI ; XU, XUHUI ; GAO, QUAN ; LI, DONGMEI ; CUI, BIN ; LIU, DESHENG ; QU, FANYAO . Bifunctional GeC/SnSSe heterostructure for high-efficient photocatalyst and photovoltaic devices. Nanoscale, v. 14, p. 7292-7302, 2022.	A1
27	LI, XUE ; WANG, WEI ; ZHAO, NING ; YANG, HAO ; HAN, SHIXUAN ; LIU, WEN ; WANG, HAILONG ; QU, FANYAO ; HAO, NING ; FU, JIYONG ; ZHANG, PING . Intense high-frequency laser-field control of spin-orbit coupling in GaInAs/AlInAs quantum wells: A laser dressing effect. PHYSICAL REVIEW B, v. 106, p. 155420, 2022.	A1
28	BRANDÃO, DAVID S. ; CASTRO, ERONILDO C. ; ZENG, HAO ; ZHAO, JIANHUA ; DINIZ, GINETOM S. ; FU, JIYONG ; FONSECA, A. L. A. ; JÚNIOR, CELSO A. N. ; QU, FANYAO . Phonon-Fostered Valley Polarization of Interlayer Excitons in van der Waals Heterostructures. Journal of Physical Chemistry C, v. xx, p. xx, 2022.	A1
29	DIAS, ALEXANDRE C. ; SILVEIRA, JULIAN F.R.V. ; QU, FANYAO . WanTiBEXOS: a Wannier based Tight Binding code for electronic band structure, excitonic and optoelectronic properties of solids. COMPUTER PHYSICS COMMUNICATIONS, v. 16, p. 108636, 2022.	A2
30	LIU, FUJUN ; QU, FANYAO ; 'UTI', IGOR ; MALARD, MARIANA . Vacancy-engineered nodal-line semimetals. Scientific Reports, v. 12, p. 14981, 2022.	A1
31	LIMA, IGO TÔRRES ; CRISPIM, JOSIEL DA SILVA ; DE SÁ NETO, OLIMPIO PEREIRA ; DE SOUSA JÚNIOR, RAFAEL TIMÓTEO ; RIBEIRO JÚNIOR, LUIZ ANTÔNIO ; DA SILVA FILHO, DEMÉTRIO ANTONIO . Organic Electronics from Nature: Computational Investigation of the Electronic and Optical Properties of the Isomers of Bixin and Norbixin Present in the Achiote Seeds. MOLECULES, v. 27, p. 2138, 2022.	A2
32	BISPO, MATHEUS DE OLIVEIRA ; FILHO, DEMÉTRIO ANTÔNIO DA SILVA . Long-range parameter optimization for a better description of potential energy surfaces using Density Functional Theory. JOURNAL OF MOLECULAR MODELING, v. 28, p. 121, 2022.	A4
33	LEMOS SILVA, RODRIGO A. ; SCALABRINI MACHADO, DANIEL F. ; NUNES RODRIGUES, NÚBIA MARIA ; DE OLIVEIRA, HEIBBE C. B. ; RIBEIRO, LUCIANO ; da Silva Filho, Demétrio A. . Harnessing Greenhouse Gases Absorption by Doped Fullerenes with Externally Oriented Electric Field. MOLECULES, v. 27, p. 2968, 2022.	A2
34	REIS, RENATA LOPES ; FILHO, DEMÉTRIO A. DA SILVA . The effect of positional disorder and the Beer-Lambert law in organic photovoltaics. JOURNAL OF MOLECULAR MODELING, v. 28, p. 330, 2022.	A4
35	LEMOS SILVA, RODRIGO A. ; SCALABRINI MACHADO, DANIEL F. ; DE OLIVEIRA, HEIBBE C. B. ; RIBEIRO, LUCIANO ; da Silva Filho, Demétrio A. . Theoretical study of the interaction of fullerenes with the emerging contaminant carbamazepine for detection in aqueous environments. Scientific Reports, v. 12, p. 15848, 2022.	A1
36	FERREIRA, JOSÉ WILSON DOS SANTOS ; MARROQUIN, JOHN FREDY RICARDO ; FELIX, Jorlandio Francisco ; FARIAS, MARCIO MUNIZ ; CASAGRANDE, MICHÉLE DAL TOÉ . The feasibility of recycled micro polyethylene terephthalate (PET) replacing natural sand in hot-mix asphalt. CONSTRUCTION AND BUILDING MATERIALS, v. 330, p. 127276, 2022.	-
37	LENZ, GUILHERME FELIPE ; SELINGER, BRUNO HENRIQUE ; SEQUINEL, RODRIGO ; ROSA DA SILVA, FABIANO ; MANZANI, DANILO ; FELIX, Jorlandio Francisco ; SCHNEIDER, RICARDO . Simple and low-cost transition metal-free borophosphate glass catalyst for aromatic alcohol oxidation by sodium hypochlorite. Journal of Materials Research and Technology-JMR&T, v. 19, p. 1457-1471, 2022.	A1
38	LACERDA FERNANDES, ÍTALO ; PEREIRA BARBOSA, DANNS ; BOTELHO DE OLIVEIRA, SÉRGIO ; ANTÔNIO DA SILVA, VALDEIR ; HENRIQUE SOUSA, MARCELO ; MONTERO-MUÑOZ, MARLY ; A. H. COAQUIRA, JOSÉ . Synthesis and characterization of the MNP@SiO2@TiO2 nanocomposite showing strong photocatalytic activity against methylene blue dye. APPLIED SURFACE SCIENCE, v. 580, p. 152195, 202	A1
39	PAZ-CORRALES, K J ; VILCA-HUAYHUA, C A ; ARAGÓN, F F H ; VILLEGAS-LELOVSKY, L ; Coaquira, J A H ; DA SILVA, S W ; MARQUES, G E ; TEODORO, M D ; PACHECO-SALAZAR, D G . Tuning intrinsic defects in ZnO films by controlling the vacuum annealing temperature: an experimental and theoretical approach. Physica Scripta, v. 97, p. 075811, 2022.	A4
40	PEREIRA JÚNIOR, M.L. ; DA CUNHA, W.F. ; DE SOUSA JUNIOR, R.T. ; AMVAME NZE, G.D. ; GALVÃO, D.S. ; RIBEIRO JÚNIOR, L.A. . Dynamics and structural transformations of carbon onion-like structures under high-velocity impacts. CARBON, v. 189, p. 422-429, 2022.	A1
41	DA SILVA CARVALHO, DANIEL ; VIANA DE ALECRIM, MARCOS MARTINHO ; DE SOUSA JÚNIOR, RAFAEL TIMÓTEO ; RIBEIRO JÚNIOR, LUIZ ANTÔNIO . Outcome of sex determination from ulnar and radial ridge densities of Brazilians? fingerprints: Applying an existing method to a new population. SCIENCE & JUSTICE, v. 62, p. 181-192, 2022.	-
42	PEREIRA JÚNIOR, MARCELO LOPES ; DA CUNHA, WILIAM F. ; DE SOUSA JUNIOR, RAFAEL TIMÓTEO ; AMVAME NZE, GEORGES DANIEL ; GALVAO, D. S. ; RIBEIRO JUNIOR, LUIZ ANTONIO . On the Thermomechanical Properties and Fracture Patterns of the Novel Nonbenzenoid Carbon Allotrope (Biphenylene Network): A Reactive Molecular Dynamics Study. Nanoscale, v. x, p. x-x, 2022.	A1
43	JÚNIOR, MARCELO LOPES PEREIRA ; DE SOUSA JUNIOR, RAFAEL TIMÓTEO ; NZE, GEORGES DANIEL AMVAME ; GIOZZA, WILLIAM FERREIRA ; JÚNIOR, LUIZ ANTÔNIO RIBEIRO . Evaluation of Peppermint Leaf Flavonoids as SARS-CoV-2 Spike Receptor-Binding Domain Attachment Inhibitors to the Human ACE2 Receptor: A Molecular Docking Study. OPEN JOURNAL OF BIOPHYSICS, v. 12, p. 132-152, 2022.	-
44	CARVALHO, DANIEL DA SILVA ; ALECRIM, MARCOS MARTINHO VIANA DE ; LOBO, BERNARDO JOSÉ MUNHOZ ; FERNANDEZ, RAMON SANTOS ; EVANGELISTA, ALESSANDRO MENDES SOARES ; MIRANDA, CLAUBER FRANCO ; RIBEIRO JUNIOR, LUIZ ANTONIO ; SOUSA JUNIOR, RAFAEL TIMÓTEO DE . Determinação do sexo a partir da densidade de linhas distal e proximal das impressões digitais de brasileiros. RESEARCH, SOCIETY AND DEVELOPMENT, v. 11, p. e7311528057, 2022.	-
45	PEREIRA JÚNIOR, MARCELO LOPES ; OLIVEIRA, TAINÁ DE SOUSA ; MONTEIRO, FÁBIO FERREIRA ; DA CUNHA, WILIAM F. ; NETO, PEDRO HENRIQUE ; RIBEIRO JUNIOR, LUIZ ANTONIO . Torsional Fracture of Carbon Nanotube Bundles: A Reactive Molecular Dynamics Study. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v. x, p. x-x, 2022.	A1
46	TROMER, RAPHAEL M. ; RIBEIRO, LUIZ A. ; GALVÃO, DOUGLAS S. . A DFT study of the electronic, optical, and mechanical properties of a recently synthesized monolayer fullerene network. CHEMICAL PHYSICS LETTERS, v. x, p. 139925-x, 2022.	A3
44	BRANDÃO, W.H.S. ; AGUIAR, A.L. ; RIBEIRO, L.A. ; GALVÃO, D.S. ; DE SOUSA, J.M. . A computational study on the mechanical properties of Pentahexoctite single-layer: Combining DFT and classical molecular dynamics simulations. CHEMICAL PHYSICS, v. x, p. 111686-x, 2022.	A4
45	JUNIOR, L.A. RIBEIRO; JUNIOR, M.L. PEREIRA ; GIOZZA, W.F. ; TROMER, R.M. ; GALVÃO, DOUGLAS S. . Thermal stability and fracture patterns of a recently synthesized monolayer fullerene network: A reactive molecular dynamics study. CHEMICAL PHYSICS LETTERS, v. x, p. 140075-x, 2022.	A3
46	MARTINS, F. H. ; PILATI, V. ; PAULA, F.L.O. ; GOMES, R.C. ; PERZYNSKI, R. ; DEPEYROT, J. . Lattice Strain of Zn-Mn Mixed Ferrite Nanocrystals in a Core-Shell Morpho-Chemical Structure. MATERIALS RESEARCH, v. 25, p. 531, 2022.	A2
47	GOMIDE, G. ; CABREIRA GOMES, RAFAEL ; GOMES VIANA, MÁRCIO ; CORTEZ CAMPOS, ALEX FABIANO ; AQUINO, RENATA ; LÓPEZ-ORTEGA, ALBERTO ; PERZYNSKI, RÉGINE ; DEPEYROT, J. . Nanoparticle Size Distribution and Surface Effects on the Thermal Dependence of Magnetic Anisotropy. Journal of Physical Chemistry C, v. 126, p. 1581-1589, 2022.	A1
48	CHAND, MAHESH ; SHANKAR, AJAY ; FABIANO CORTEZ CAMPOS, ALEX ; PRASAD PANT, RAJENDER ; DEPEYROT, JEROME . Reversible, voluminous and tunable patterning of multiwalled carbon nanotubes in ferrofluid: partial or complete?. APPLIED SURFACE SCIENCE, v. 604, p. 154283-18 p, 2022.	A1
49	SILVA, FRANCISCSILVA, FRANCISCARLOS GOMES DA ; VASILAKAKI, MARIANNA ; CABREIRA GOMES, RAFAEL ; AQUINO, RENATA ; CAMPOS, ALEX FABIANO CORTEZ ; DUBOIS, EMMANUELLE ; PERZYNSKI, RÉGINE ; DEPEYROT, JÉRÔME ; TROHIDOU, KALLIOPI . A numerical study on the interplay between the intra-particle and interparticle characteristics in bimagnetic soft/soft and hard/soft ultrasmall nanoparticle assemblies. Nanoscale Advances, v. xx, p. xxxxxx, 2022.ARLOS GOMES DA ; VASILAKAKI, MARIANNA ; CABREIRA GOMES, RAFAEL ; AQUINO, RENATA ; CAMPOS, ALEX FABIANO CORTEZ ; DUBOIS, EMMANUELLE ; PERZYNSKI, RÉGINE ; DEPEYROT, JÉRÔME ; TROHIDOU, KALLIOPI . A numerical study on the interplay between the intra-particle and interparticle characteristics in bimagnetic soft/soft and hard/soft ultrasmall nanoparticle assemblies. Nanoscale Advances, v. xx, p. xxxxxx, 2022.	B1
50	DE SOUSA, LEONARDO EVARISTO ; DOS SANTOS BORN, LARISSA ; DE OLIVEIRA NETO, PEDRO HENRIQUE ; DE SILVA, PIOTR . Triplet-to-singlet exciton transfer in hyperfluorescent OLED materials. Journal of Materials Chemistry C, v. 1, p. 1, 2022.	A1
51	Rocha Filho, T.M.; MENDES, JOSÉ F. F. ; MURARI, T. ; NASCIMENTO FILHO, A. S. ; CORDEIRO, A.J.A. ; RAMALHO, W. M. ; SCORZA, F.A. ; ALMEIDA, A.-C.G. ; MORET, MARCELO A. . Optimization of COVID-19 vaccination and the role of individuals with a high number of contacts: A model based approach. PLoS One, v. 17, p. e0262433-1-e0262433-13, 2022.	A1
52	SOUZA, LURYANE F. ; Rocha Filho, Tarcísio M. ; MORET, MARCELO A. . Relating SARS-CoV-2 variants using cellular automata imaging. Scientific Reports, v. 12, p. 10297, 2022.	A1
53	MURARI, THIAGO B. ; FONSECA, LARISSA MORAES DOS SANTOS ; PEREIRA, HERNANE B. DE B. ; NASCIMENTO FILHO, ALOÍSIO S. ; SABA, HUGO ; SCORZA, FULVIO A. ; G. DE ALMEIDA, ANTÔNIO-CARLOS ; MACIEL, ETHEL L. N. ; MENDES, JOSÉ F. F. ; Rocha Filho, Tarcísio M. ; DAVID, JOHN R. ; BADARÓ, ROBERTO ; MACHADO, BRUNA APARECIDA SOUZA ; MORET, MARCELO A. . Retrospective Cohort Study of COVID-19 in Patients of the Brazilian Public Health System with SARS-CoV-2 Omicron Variant Infection. Vaccines, v. 10, p. 1504, 2022.	A3
54	GONÇALVES, MARCELO ALBANO MORET SIMÕES ; MURARI, THIAGO BARROS ; LÚCIO, MAGDA DE LIMA ; ROCHA FILHO, TARCISIO MARCIANO DA . O vírus que parou o mundo - um panorama sobre a pandemia de COVID-19. Vigilância Sanitária em Debate: Sociedade, Ciência & Tecnologia, v. 10, p. 44, 2022.	-
55	WEBER, P.E.R. ; LULA-ROCHA, V.N.A. ; PEREIRA, J.C.C. ; TRINDADE, M.A.S. ; FILHO, L.M. SILVA ; Martins, M.G.R. ; Santana, A.E. ; Vianna, J.D.M. . Non-classical properties of superposition thermal quantum states. ANNALS OF PHYSICS, v. 2022, p. 168986, 2022.	A2
56	DESSANO, H. ; PETRONILO, G. X. A. ; AMORIM, R. G. G. ; SANTANA, A. E. . Phase space Schrödinger equation and quadratic friction. JOURNAL OF MATHEMATICAL PHYSICS, v. 63, p. 022101, 2022.	A4
57	MOREIRA, R. P. M. ; PETRONILO, G. X. A. ; SANTANA, A. E. ; AMORIM, R. G. G. ; Belich, H. . CPT-even electrodynamics in a multidimensional torus: Casimir effect at finite temperature. EUROPEAN PHYSICAL JOURNAL C. PARTICLES AND FIELDS, v. 82, p. 82:999-1-82:999-8, 2022.	A2
58	LUZ, RENATO ; PETRONILO, GUSTAVO ; DE SANTANA, Ademir ; COSTA, CAROLINE ; AMORIM, RONNI ; PAIVA, RENDISLEY . Quark-Antiquark Effective Potential in Symplectic Quantum Mechanics. Advances in High Energy Physics, v. 2022, p. 1-10, 2022.	B1
59	CANGUSSU, LILIAN MENDES BORBUREMA ; DE SOUZA, LUDMILLA REGINA ; DE SOUZA, MARCELA GONÇALVES ; JUNIOR, RENATO SOBRAL MONTEIRO ; MUEHLMANN, LUIS ALEXANDRE ; DE SOUZA, PAULO NARCIZO ; FARIAS, LUCYANA CONCEIÇÃO ; SANTOS, SÉRGIO HENRIQUE SOUSA ; DE PAULA, ALFREDO MAURÍCIO BATISTA ; GUIMARÃES, ANDRÉ LUIZ SENA . Photodynamic therapy mediated by nanoparticles Aluminum Chloro Phthalocyanine in oral squamous carcinoma cells. Lasers in Medical Science (on line), v. 37, p. 2509-2516, 2022.	A2
60	DE SOUSA NETO, IVO VIEIRA ; PRESTES, JONATO ; PEREIRA, GUILHERME BORGES ; ALMEIDA, JEESER ALVES ; RAMOS, GRACIELE VIEIRA ; DE SOUZA, FABIANE HIRATSUKA VEIGA ; DE SOUZA, PAULO EDUARDO NARCIZO ; TIBANA, RAMIRES ALSAMIR ; FRANCO, OCTAVIO LUIZ ; DURIGAN, JOÃO LUIZ QUAGLIOTI ; NEVES, RODRIGO VANERSON PASSOS ; DOS SANTOS ROSA, THIAGO ; FONTES, WAGNER ; DE CASSIA MARQUETI, RITA . Protective role of intergenerational paternal resistance training on fibrosis, inflammatory profile, and redox status in the adipose tissue of rat offspring fed with a high-fat diet. LIFE SCIENCES, v. 295, p. 120377, 2022.	A1
61	PAULINI, FERNANDA ; MARANGON, ALINE R. M. ; AZEVEDO, CAROLINA L. ; BRITO, JULIANA L. M. ; LEMOS, MARCELLE S. ; SOUSA, MARCELO H. ; VEIGA-SOUZA, FABIANE H. ; SOUZA, PAULO E. N. ; LUCCI, CAROLINA M. ; AZEVEDO, RICARDO B. . In Vivo Evaluation of DMSA-Coated Magnetic Nanoparticle Toxicity and Biodistribution in Rats: A Long-Term Follow-Up. Nanomaterials, v. 12, p. 3513, 2022.	A3
62	SPANIOL, E. P. ; AMORIM, R.G.G. ; ULHOA, S. C. . On the Hilbert Space in Quantum Gravity. UNIVERSE, v. 2022, p. 413, 2022.	B1
63	CARNEIRO, F.L. ; Ulhoa, S.C. ; Maluf, J.W. ; DA ROCHA-NETO, J.F. . On the total energy conservation of the Alcubierre spacetime. JOURNAL OF COSMOLOGY AND ASTROPARTICLE PHYSICS, v. 2022, p. 030, 2022.	A1
64	CARNEIRO, F. L. ; ULHOA, S. C. ; MALUF, J. W. . On the Black Hole Acceleration in the C-Metric Space-Time. Gravitation & Cosmology, v. 28, p. 352-361, 2022	B2
65	BARBOSA, LEONARDO S. ; DE ALMEIDA, BRUNA C.C. ; Moreira, Edvan ; Azevedo, David L. . First-principle investigation of boron nitride nanobelt. Computational and Theoretical Chemistry, v. 1208, p. 113571, 2022.	A4
66	MIRANDA, W.D.S.A. ; FRAZÃO, N.F. ; Moreira, E. ; Azevedo, D.L. . Penta-belt: a new carbon nanobelt. JOURNAL OF MOLECULAR STRUCTURE, v. 1263, p. 133055, 2022.	A3
67	MOUCHEREK, F.M.O. ; SANTOS, W.O. ; NOVAIS, A.L.F. ; Moreira, E. ; Azevedo, D.L. . Prediction of electronic and optical properties of monoclinic 1T?-phase OsSe2 monolayer using DFT principles. Materials Today Communications, v. 33, p. 104764, 2022.	A4
68	CARVALHO, R.C. ; MENDONÇA, M.E.V. ; TAVARES, M.S. ; Moreira, E. ; Azevedo, D.L. . Optoelectronic and thermodynamic properties, infrared and Raman spectra of NbO2 and Nb2O5 from DFT formalism. JOURNAL OF PHYSICS AND CHEMISTRY OF SOLIDS, v. 163, p. 110549, 2022.	A2
69	BALACHANDRAN, A P ; CALDERÓN, F ; NAIR, V P ; PINZUL, ALEKSANDR ; REYES-LEGA, A F ; VAIDYA, S . Uncertainties in quantum measurements: a quantum tomography. Journal of Physics A-Mathematical and Theoretical, v. 55, p. 225309, 2022.	A2
70	BALACHANDRAN, A.'P. ; NAIR, V.'P. ; Pinzul, A. ; REYES-LEGA, A.'F. ; Vaidya, S. . Superselection, boundary algebras, and duality in gauge theories. PHYSICAL REVIEW D, v. 106, p. 025001, 2022.	A1
71	DIAS, A. C. ; BRAGANÇA, HELENA ; LIMA, MATHEUS P. ; DA SILVA, JUAREZ L. F. . First-principles investigation of the role of Cr in the electronic properties of the two-dimensional Mo x Cr 1 − x Se . PHYSICAL REVIEW MATERIALS, v. 6, p. 54001, 2022.	A3
72	CARVALHO, ISAAC M. ; BRAGANÇA, HELENA ; BRITO, WALBER H. ; AGUIAR, MARIA C. O. . Formation of spin and charge ordering in the extended Hubbard model during a finite-time quantum quench. PHYSICAL REVIEW B, v. 106, p. 195405, 2022.	A1
73	INUI, GUILHERME K. ; SILVEIRA, JULIAN F. R. V. ; Dias, Alexandre Cavalheiro ; BESSE, RAFAEL ; DA SILVA, JUAREZ L. F. . Ab initio Screening of Two-dimensional CuQx and AgQx Chalcogenides. JOURNAL OF PHYSICS-CONDENSED MATTER, v. 34, p. 305703, 2022.	A3

   

 

2021

 

Número	Artigo	Qualis
1	ARAGON, FERMIN F.H. ; HAECK, CLEMENT M. ; Morais, Paulo C. ; VARIANO, BRUCE . Polymorphism characterization of segesterone acetate: A comprehensive study using XRPD, FT-IR and Raman spectroscopy. INTERNATIONAL JOURNAL OF PHARMACEUTICS, v. 596, p. 120234, 2021.	A1
2	DING, HAIZHEN ; WANG, DONG ; SADAT, ANWAR ; LI, ZHENZHEN ; HU, XIAOLONG ; XU, MINGSHENG ; DE MORAIS, PAULO C. ; GE, BINGHUI ; SUN, SONG ; GE, JIECHAO ; CHEN, YAN ; QIAN, YINFENG ; SHEN, CHENGLIANG ; SHI, XIANYANG ; HUANG, XIN ; ZHANG, REN-QUAN ; BI, HONG . Single-Atom Gadolinium Anchored on Graphene Quantum Dots as a Magnetic Resonance Signal Amplifier. ACS Applied Bio Materials, v. 4, p. 2798-2809, 2021.	B2
3	ALVES, ANDRÉ LUÍZ ; LEITÃO, ANTÓNIO EDUARDO BATISTA ; SOUZA, PAULO EDUARDO NARCIZO DE ; SANTOS, MARIA DE FÁTIMA PEREIRA DOS ; MOSCON, PAULO SÉRGIO ; PESSOA, MARCIO SOLINO ; PINHEIRO, CARLOS ALEXANDRE ; MORAIS, PAULO CÉSAR ; PARTELLI, FÁBIO LUIZ . Antioxidant Activity and Stable Free Radicals in Robusta Green Coffee Genotypes/ Atividade antioxidante e Radicais Estáveis Livres em Genótipos de Café Verde Robusta. Brazilian Journal of Development, v. 7, p. 37312-37330, 2021.	C
4	BATISTA, ELISSON A. ; SILVA, ANIELLE C. A. ; DE L. REZENDE, THAÍS K. ; GUIMARÃES, EDER V. ; PEREIRA, PEDRO A. G. ; DE SOUZA, PAULO E. N. ; DA SILVA, RICARDO S. ; DE MORAIS, PAULO C. ; DANTAS, NOELIO O. . Modulating the magnetic-optical properties of Zn1−xCoxO nanocrystals with x-content. JOURNAL OF MATERIALS RESEARCH, v. 36, p. 1657-1665, 2021.	A2
5	FERRAZ, I.S.B. ; CASTRO, T.J. ; MANTILLA, J. ; COAQUIRA, J.A.H. ; GARG, V.K. ; OLIVEIRA, A.C. ; FRANCO, A. ; MORAIS, P.C. ; DA SILVA, S.W. . Structural, optical and magnetic properties of CoAl Fe2-O4 nanoparticles prepared by combustion reaction method. JOURNAL OF ALLOYS AND COMPOUNDS, v. 887, p. 161398, 2021.	A1
6	RODRIGUES, GISELE ; GONÇALVES DA COSTA SOUSA, MAURICIO ; DA SILVA, DIEIME CUSTÓDIA ; BERTO REZENDE, TAIA MARIA ; DE MORAIS, PAULO CÉSAR ; FRANCO, OCTÁVIO LUIZ . Nanostrategies to Develop Current Antiviral Vaccines. ACS Applied Bio Materials, v. 4, p. 3880-3890, 2021.	B2
7	WOODS, LILIA M. ; KRÜGER, MATTHIAS ; Dodonov, Victor V. . Perspective on Some Recent and Future Developments in Casimir Interactions. Applied Sciences-Basel, v. 11, p. 293, 2021.	A3
8	DODONOV, V.V.; HOROVITS, M.B. . Change of energy and magnetic moment of a quantum charged particle after a fast jump of the magnetic field in solenoids of arbitrary cross sections. PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS, v. 571, p. 125843, 2021.	A1
9	Dodonov, Viktor V.. Excitation of a Moving Oscillator. JOURNAL OF RUSSIAN LASER RESEARCH, v. 42, p. 243-249, 2021.	B1
10	Dodonov, Viktor V.. Invariant Quantum States of Quadratic Hamiltonians. Entropy, v. 23, p. 634, 2021.	A2
11	Dodonov, V V. Magnetization dynamics of a harmonically confined quantum charged particle in time dependent magnetic fields inside a circular solenoid. Journal of Physics A: Mathematical and Theoretical, v. 54, p. 295304, 2021.	A2
12	DE FREITAS, MIGUEL CITELI ; Dodonov, Viktor V. . Non-Gaussianity of Four-Photon Superpositions of Fock States. Quantum Reports, v. 3, p. 350-365, 2021.	C
13	Dodonov, Viktor V.; HOROVITS, MATHEUS B. . Energy and Magnetic Moment of a Quantum Charged Particle in Time-Dependent Magnetic and Electric Fields of Circular and Plane Solenoids. Entropy, v. 23, p. 1579, 2021.	A2
14	TUMBARELL ARANDA, ORESTES ; PENNA, ANDRÉ L.A. ; Oliveira, Fernando A. . Nonlinear self-organized population dynamics induced by external selective nonlocal processes. Communications in Nonlinear Science and Numerical Simulation, v. 93, p. 105512, 2021.	A1
15	GOMES-FILHO, MÁRCIO S. ; Oliveira, Fernando A. . The hidden fluctuation-dissipation theorem for growth (a). EPL, v. 133, p. 10001, 2021.	A3
16	ARANDA, ORESTES TUMBARELL ; PENNA, ANDRÉ L.A. ; Oliveira, Fernando A. . Nonlocal pattern formation effects in evolutionary population dynamics. PHYSICA A-STATISTICAL MECHANICS AND ITS APPLICATIONS, v. 572, p. 125865, 2021.	A1
17	GOMES-FILHO, MÁRCIO S. ; PENNA, ANDRÉ L.A. ; Oliveira, Fernando A. . The Kardar-Parisi-Zhang exponents for the dimensions. Results in Physics, v. 26, p. 104435, 2021.	A4
18	DOS ANJOS, PETRUS H. R. ; GOMES-FILHO, MÁRCIO S. ; ALVES, WASHINGTON S. ; AZEVEDO, DAVID L. ; Oliveira, Fernando A. . The Fractal Geometry of Growth: Fluctuation-Dissipation Theorem and Hidden Symmetry. Frontiers in Physics, v. 9, p. 566, 2021.	B1
19	SANTOS, DÉBORA S. ; MORAIS, JOSÉ ATHAYDE V. ; VANDERLEI, ÍSIS A.C. ; SANTOS, ALEXANDRE S. ; AZEVEDO, RICARDO B. ; MUEHLMANN, LUÍS A. ; JÚNIOR, OSMINDO R.P. ; MORTARI, MÁRCIA R. ; DA SILVA, JAQUELINE R. ; da Silva, Sebastião W. ; LONGO, JOÃO P.F. . Oral delivery of fish oil in oil-in-water nanoemulsion: Development, colloidal stability and modulatory effect on in vivo inflammatory induction in mice. BIOMEDICINE & PHARMACOTHERAPY, v. 133, p. 110980, 2021.	A2
20	ARAGÓN, F.F.H. ; COAQUIRA, J.A.H. ; da SILVA, S.W. ; COHEN, R. ; PACHECOS-SALAZAR, D.G. ; NAGAMINE, L.C.C.M. . Fe content effects on structural, electrical and magnetic properties of Fe-doped ITO polycrystalline powders. JOURNAL OF ALLOYS AND COMPOUNDS, v. 867, p. 158866, 2021.	A1
21	OLIVEIRA-FILHO, G.B. ; ATOCHE-MEDRANO, J.J. ; ARAGÓN, F.F.H. ; MANTILLA OCHOA, J.C. ; PACHECO-SALAZAR, D.G. ; da SILVA, S.W. ; COAQUIRA, J.A.H. . Core-shell Au/Fe3O4 nanocomposite synthesized by thermal decomposition method: Structural, optical, and magnetic properties. APPLIED SURFACE SCIENCE, v. 563, p. 150290, 2021.	A1
22	DE MACEDO, LUIZ GUILHERME MACHADO ; NEVES, ERIC RAFAEL ; DE OLIVEIRA SÓ, YURI ALVES ; Gargano, Ricardo . Relativistic four-component potential energy curves for the lowest 23 covalent states of molecular astatine (At2). SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, v. 245, p. 118869, 2021.	A1
23	CARVALHO, FERNANDO M. ; KIAMETIS, ALESSANDRA SOFIA ; DE ARAÚJO OLIVEIRA, ALAN LEONE ; PIRANI, Fernando ; Gargano, Ricardo . Spectroscopy, lifetime, and charge-displacement of the methanol-noble gas complexes: An integrated experimental-theoretical investigation. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, v. 246, p. 119049, 2021.	A1
24	FERREIRA DE MENEZES, RAFAEL ; MACHADO DE MACEDO, LUIZ GUILHERME ; LOPES MARTINS, JOÃO BATISTA ; PIRANI, Fernando ; Gargano, Ricardo . Investigation of strength and nature of the weak intermolecular bond in NH2 radical-noble gas atom adducts and evaluation of their basic spectroscopic features. CHEMICAL PHYSICS LETTERS, v. 769, p. 138386, 2021.	A3
25	MIRANDA, WILSON D. S. ALVES ; MOREIRA, EDVAN ; TAVARES, MARCIO S. ; COUTINHO, SAMIR S. ; Gargano, Ricardo ; AZEVEDO, DAVID L. . BN adamantane isomers: an optical absorption spectrum study. APPLIED PHYSICS A-MATERIALS SCIENCE & PROCESSING, v. 127, p. 32, 2021.	A3
26	DE ARAUJO OLIVEIRA, ALAN LEONE ; DE MACEDO, LUIZ GUILHERME MACHADO ; DE OLIVEIRA SÓ, YURI ALVES ; MARTINS, João Batista Lopes ; PIRANI, Fernando ; Gargano, Ricardo . Nature and role of the weak intermolecular bond in enantiomeric conformations of H O -noble gas adducts: a chiral prototypical model. NEW JOURNAL OF CHEMISTRY, v. 45, p. 8240-8247, 2021.	A2
27	DE ANDRADE RAMOS, GISELLE ; SOUZA DE OLIVEIRA, ANDRESSA ; BARTOLINI, MANUELA ; NALDI, MARINA ; LIPARULO, IRENE ; BERGAMINI, CHRISTIAN ; ULIASSI, ELISA ; WU, LING ; FRASER, PAUL E. ; ABREU, MONICA ; KIAMETIS, ALESSANDRA SOFIA ; Gargano, Ricardo ; SILVEIRA, EDILBERTO ROCHA ; BRAND, GUILHERME D. ; PRCHAL, LUKAS ; SOUKUP, OND'EJ ; KORÁBEč ; BOLOGNESI, MARIA LAURA ; SOARES ROMEIRO, LUIZ ANTONIO . Discovery of sustainable drugs for Alzheimer's disease: cardanol-derived cholinesterase inhibitors with antioxidant and anti-amyloid properties. RSC Medicinal Chemistry, v. xx, p. xx-xx, 2021.	B3
28	DE OLIVEIRA, RHUIAGO MENDES ; MACHADO DE MACEDO, LUIZ GUILHERME ; DA CUNHA, THIAGO FERREIRA ; PIRANI, Fernando ; Gargano, Ricardo . A Spectroscopic Validation of the Improved Lennard-Jones Model. MOLECULES, v. 26, p. 3906, 2021.	A2
29	LIMA, FRANCIELLE C. ; SÓ, YURI A.O. ; Gargano, Ricardo ; DE OLIVEIRA, DIÊGO M. ; GATTO, CLAUDIA C. . Structural, theoretical and biological activity of mono and binuclear nickel(II) complexes with symmetrical and asymmetrical 4,6-diacetylresorcinol-dithiocarbazate ligands. JOURNAL OF INORGANIC BIOCHEMISTRY, v. xx, p. 111559, 2021.	A2
30	CARVALHO, FERNANDO MARQUES ; SÓ, YURI ALVES DE OLIVEIRA ; WERNIK, ALESSANDRA SOFIA KIAMETIS ; SILVA, MÔNICA DE ABREU ; Gargano, Ricardo . Accurate acid dissociation constant (pKa) calculation for the sulfachloropyridazine and similar molecules. JOURNAL OF MOLECULAR MODELING, v. 27, p. 233, 2021.	A4
31	DE MACEDO, LUIZ GUILHERME MACHADO ; WANZELER, HERACLES PEREIRA ; DIAS, GABRIEL HENRIQUE LANGE ; Gargano, Ricardo . Relativistic four-component MRCISD+Q calculations of the six lowest valence states of molecular F$_{2}^{-}$ anion including Breit interactions. JOURNAL OF MOLECULAR MODELING, v. 27, p. 230, 2021.	A4
32	PINHEIRO, ALAN SENA ; Gargano, Ricardo ; SANTOS, PAULO HENRIQUE GOMES DOS ; DE MACEDO, LUIZ GUILHERME MACHADO . Fully relativistic study of polyatomic closed shell E121X3 (X = F, Cl, Br) molecules: effects of Gaunt interaction, relativistic effects and advantages of an exact-two component (X2C) hamiltonian. JOURNAL OF MOLECULAR MODELING, v. 27, p. 262, 2021.	A4
33	da Cunha, Wiliam F. ; PEREIRA JÚNIOR, MARCELO L. ; GIOZZA, WILLIAM F. ; DE SOUSA JUNIOR, RAFAEL T. ; RIBEIRO JÚNIOR, LUIZ A. ; E SILVA, GERALDO M. . Polaron transport in porous graphene nanoribbons. COMPUTATIONAL MATERIALS SCIENCE, v. 194, p. 110423, 2021.	A1
34	PEREIRA JÚNIOR, MARCELO LOPES ; de Oliveira Neto, Pedro Henrique ; DA SILVA FILHO, DEMÉTRIO ANTÔNIO ; DE SOUSA, LEONARDO EVARISTO ; E SILVA, GERALDO MAGELA ; RIBEIRO JÚNIOR, LUIZ ANTÔNIO . Charge localization and hopping in a topologically engineered graphene nanoribbon. Scientific Reports, v. 11, p. 11:5142, 2021.	A1
35	LU, QIUXIA ; XIE, SHIJIE ; QU, FANYAO . Hopping-Dominated Spin Transport in Unintentionally Doped Organic Semiconductors. Journal of Physical Chemistry Letters, v. 12, p. 3540-3544, 2021.	A1
36	LIU, F. ; QU, F. ; 'UTI', I. ; XIE, S. ; LIU, D. ; FONSECA, A. L. A. ; MALARD, M. . Robust Topological Nodal-Line Semimetals from Periodic Vacancies in Two-Dimensional Materials. Journal of Physical Chemistry Letters, v. 12, p. 5710-5715, 2021.	A1
37	ZHAO, XIUWEN ; LIU, FUJUN ; REN, JUNFENG ; QU, FANYAO . Valleytronic and magneto-optical properties of Janus and conventional and heterostructures. PHYSICAL REVIEW B, v. 104, p. 085119, 2021.	A1
38	JIANG, XINXIN ; GAO, QUAN ; XU, XUHUI ; XU, GE ; LI, DONGMEI ; CUI, BIN ; LIU, DESHENG ; QU, FANYAO . Design of a noble-metal-free direct Z-scheme photocatalyst for overall water splitting based on SnC/SnSSe van der Waals heterostructure. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v. 20, p. 1, 2021.	A1
39	MA, YALIN ; WANG, QINGXUAN ; HAN, SHIXUAN ; QU, FANYAO ; FU, JIYONG . Fine structure mediated magnetic response of trion valley polarization in monolayer. PHYSICAL REVIEW B, v. 104, p. 195424, 2021.	A1
40	DOS SANTOS, RAMIRO M ; GIOZZA, WILLIAM F ; DE SOUSA JÚNIOR, RAFAEL T ; DA SILVA FILHO, DEMÉTRIO A ; RIBEIRO JÚNIOR, LUIZ A . On the electronic structure of a recently synthesized graphene-like BCN monolayer from bis-BN cyclohexane with single-atom vacancies: a DFT study. Electronic Structure, v. 3, p. 014006-NA, 2021.	B3
41	DE MELO NETO, CARLOS A.M. ; PEREIRA, MARCELO L. ; Ribeiro, Luiz A. ; Roncaratti, Luiz F. ; da Silva Filho, Demétrio A. . Theoretical prediction of electron mobility in birhodanine crystals and their sulfur analogs. CHEMICAL PHYSICS LETTERS, v. 763, p. 138226-NA, 2021.	A3
42	SIMOKAITIENE, JURATE ; CEKAVICIUTE, MONIKA ; BAUCYTE, KRISTINA ; VOLYNIUK, DMYTRO ; DURGARYAN, RANUSH ; MOLINA, DESIRÉ ; YANG, BOWEN ; SUO, JIAJIA ; KIM, YEONJU ; FILHO, DEMETRIO ANTONIO DA SILVA ; HAGFELDT, ANDERS ; SINI, GJERGJI ; GRAZULEVICIUS, JUOZAS V. . Interfacial Bulk Properties of Hole-Transporting Materials for Perovskite Solar Cells: Isomeric Triphenylamine-Based Enamines Spiro-OMeTAD. ACS Applied Materials & Interfaces, v. NA, p. acsami.1c03000, 2021.	A1
43	DOS SANTOS, RAMIRO MARCELO ; GIOZZA, WILLIAM F ; DE SOUSA JUNIOR, RAFAEL T ; DA SILVA FILHO, DEMETRIO ANTONIO ; DOS SANTOS, RENATO ; RIBEIRO JUNIOR, LUIZ ANTONIO . A DFT Study on the Electronic Structure of In-Plane Heterojunctions of Graphene and Hexagonal Boron Nitride Nanoribbons. Electronic Structure, v. na, p. NA-NA, 2021.	B3
44	LARSEN, MADS NIBE ; PETERS, MADS SVANBORG ; LEMOS-SILVA, RODRIGO ; da Silva Filho, Demetrio A. ; JØRGENSEN, BJARKE ; ALBREKTSEN, OLE ; Kjelstrup-Hansen, Jakob . Work function difference of naphthyl end-capped oligothiophene in different crystal alignments studied by Kelvin probe force microscopy. ORGANIC ELECTRONICS, v. 89, p. 106060, 2021.	A1
45	DE SOUSA, LEONARDO E ; RASO DE PAIVA, LAURA SIMONASSI ; DA SILVA FILHO, DEMETRIO ; SINI, GJERGJI ; NETO, PEDRO HENRIQUE . Assessing the Effects of Increasing Conjugation Length on Exciton Diffusion: From Small Molecules to the Polymeric Limit. PHYSICAL CHEMISTRY CHEMICAL PHYSICS, v. NA, p. NA, 2021.	A1
46	SILVA, RODRIGO A. LEMOS ; da Silva Filho, Demetrio A. ; MOBERG, MEGAN E. ; Pappenfus, Ted M. ; Janzen, Daron E. . Halogen Interactions in Halogenated Oxindoles: Crystallographic and Computational Investigations of Intermolecular Interactions. MOLECULES, v. 26, p. 5487, 2021.	A2
47	MOREIRA, FERNANDO ROCHA ; DA SILVA FILHO, DEMETRIO ANTONIO ; Nze, Georges Daniel Amvame ; DE SOUSA JUNIOR, RAFAEL TIMOTEO ; NUNES, RAFAEL RABELO . Evaluating the Performance of NIST?s Framework Cybersecurity Controls Through a Constructivist Multicriteria Methodology. IEEE Access, v. Na, p. 1-1, 2021.	A3
48	PEREIRA JÚNIOR, MARCELO LOPES ; DE OLIVEIRA NETO, PEDRO HENRIQUE ; DA SILVA FILHO, DEMÉTRIO ANTÔNIO ; DE SOUSA, LEONARDO EVARISTO ; E SILVA, GERALDO MAGELA ; RIBEIRO JÚNIOR, LUIZ ANTÔNIO . Charge localization and hopping in a topologically engineered graphene nanoribbon. Scientific Reports, v. 11, p. NA-NA, 2021.	A1
49	FRANCO, DOUGLAS F. ; FERNANDES, ROGER ; FELIX, JORLANDIO F. ; MASTELARO, VALMOR R. ; ECKERT, HELLMUT. ; AFONSO, CONRADO R.M. ; MESSADDEQ, YOUNÈS ; MESSADDEQ, SANDRA H. ; MORENCY, STEEVE ; NALIN, MARCELO . Fundamental studies of magneto-optical borogermanate glasses and derived optical fibers containing Tb3+. Journal of Materials Research and Technology-JMR&T, v. 00, p. 00, 2021.	A1
50	LOCATELLI, POLIANE P.P. ; GURTAT, MELINE ; LENZ, GUILHERME F. ; MARROQUIN, JOHN FREDY R. ; FELIX, JORLANDIO F. ; SCHNEIDER, RICARDO ; BORBA, CARLOS E. . Simple borophosphate glasses for on-demand growth of self-supported copper nanoparticles in the reduction of 4-nitrophenol. JOURNAL OF HAZARDOUS MATERIALS, v. 00, p. 125801-0, 2021.	A1
51	ARAGON, FERMIN ; VILLEGAS-LELOVSKY, LEONARDO ; CABRAL, LUIS ; PAES LIMA, MATHEUS ; MESQUITA, ALEXANDRE ; COAQUIRA, JOSÉ . Tuning the Magnetic Properties of Sn1-x-yCe4+xCe3+yO2 Nanoparticles: an Experimental and Theoretical Approach. Nanoscale Advances, v. 1, p. 1, 2021.	B1
52	Niraula, Gopal ; COAQUIRA, JOSE A.H. ; ARAGON, FERMIN H. ; GALEANO VILLAR, BIANCA M. ; MELLO, ALEXANDRE ; GARCIA, FLAVIO ; MURACA, DIEGO ; ZOPPELLARO, GIORGIO ; VARGAS, JOSE M. ; SHARMA, SURENDER K. . Tuning the shape, size, phase composition and stoichiometry of iron oxide nanoparticles: The role of phosphate anions. JOURNAL OF ALLOYS AND COMPOUNDS, v. 856, p. 156940, 2021.	A1
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