| 2024 |
Artigo em periódico |
FTIR analysis and antimicrobial activity of sodium tungstate and calcium tungstate
Silva Júlio CÉSAR; Moura Talysson FELISMINO; Da Silva Pereira Raimundo LUIZ; De Freitas Thiago SAMPAIO; Rocha Janaína ESMERALDO et al
VIBRATIONAL SPECTROSCOPY
DOI 10.1016/j.vibspec.2024.103691
ISSN 0924-2031
|
PS
Spectroscopy
|
| 2024 |
Artigo em periódico |
Synthesis; electronic and vibrational properties; solvation effects; ADME and cytotoxic assay of aqua-(1;10-phenanthroline)-tyrosinato-copper(II) nitrate dihydrate complex: experimental and theoretical studies
Pereira Walajhone O; Oliveira Neto João G; Viana Jailton R; Carvalho Guilherme G C; Pessoa CLAUDIA et al
JOURNAL OF MATERIALS SCIENCE
DOI 10.1007/s10853-024-09795-y
ISSN 0022-2461
|
PS
Organic Chemistry
|
| 2024 |
Artigo em periódico |
Crystallographic; intermolecular interactions; vibrational; and computational studies of a new cocrystal of decanoic acid and nicotinamide
De Oliveira Neto João G; Viana Jailton R; Ayala Alejandro P; Nogueira Carlos E S; De Oliveira Mauro M et al
JOURNAL OF MOLECULAR STRUCTURE
DOI 10.1016/j.molstruc.2024.138835
ISSN 0022-2860
|
PS
Physical and Theoretical Chemistry
|
| 2024 |
Artigo em periódico |
Mixed tutton salts K2Mn0.15Co0.85(SO4)2(H2O)6 and K2Mn0.16Zn0.84(SO4)2(H2O)6 for applications in thermochemical devices: experimental physicochemical properties combined with first-principles calculations
De Oliveira Neto João GOMES; Da Silva Luiz Fernando LOBATO; Alves Tiago Kalil CORTINHAS; Neumann ANDREAS; Francisco Ferreira De SOUSA et al
JOURNAL OF MATERIALS SCIENCE
DOI 10.1007/s10853-024-10049-0
ISSN 0022-2461
|
PS
Materials Science (miscellaneous)
|
| 2024 |
Artigo em periódico |
Antitumor neodymium(III) complex with 1;10-phenanthroline and nitrate ligands: a comprehensive experimental-theoretical study; in silico pharmacokinetic and cytotoxic properties
De Oliveira Neto João G; Viana Jailton R; Abreu Kamila R; Butarelli Ana L A; Dos Santos Ana P A et al
JOURNAL OF MOLECULAR STRUCTURE
DOI 10.1016/j.molstruc.2024.139757
ISSN 0022-2860
|
PS
Organic Chemistry
|
| 2024 |
Artigo em periódico |
Molecular spectroscopy; solvent effect; and DFT studies of azithromycin solvate
Rodrigues Jéssica A O; Da Silva Carliana R; Lima Antonio D S G; De Oliveira Neto João G; Bordallo Heloisa N et al
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
DOI 10.1016/j.saa.2024.125057
ISSN 1386-1425
|
PS
Spectroscopy
|
| 2024 |
Artigo em periódico |
Tutton salt (NH4)2Zn(SO4)2(H2O)6: thermostructural; spectroscopic; Hirshfeld surface; and DFT investigations
João Gomes De Oliveira NETO; Jailton Romão VIANA; Kamila R ABREU; Luiz Fernando Lobato Da SILVA; Mateus Ribeiro LAGE et al
JOURNAL OF MOLECULAR MODELING (ONLINE)
DOI 10.1007/s00894-024-06089-7
ISSN 0948-5023
|
PS
Physical and Theoretical Chemistry
|
| 2024 |
Artigo em periódico |
Dichloro-bis(theophylline)-copper(II) complex: Characterization of the physicochemical; computational pharmacokinetics; molecular docking; and cytotoxicity as potential antitumoral medicine
De Oliveira Neto João G; Viana Jailton R; Souza Júnior Marinaldo V; Queiroz Luis H S; Reis Aramys S et al
POLYHEDRON
DOI 10.1016/j.poly.2024.117234
ISSN 0277-5387
|
LS
Drug Discovery
|
| 2024 |
Artigo em periódico |
Exploring Thermal Stability; Vibrational Properties; and Biological Assessments of Dichloro( -histidine)copper(II): A Combined Theoretical and Experimental Study
Abreu Kamila R; Viana Jailton R; Oliveira Neto João G; Dias Tatielle G; Reis Aramys S et al
ACS Omega
DOI 10.1021/acsomega.4c05029
ISSN 2470-1343
|
LS
Biochemistry
|
| 2024 |
Artigo em periódico |
Vibrational; optical; electronic and electrocatalytic properties of SrCuSi4O10 ceramic
Da Silva Hilton B; Lobato Luiz F; Juca Raí F; Oliveira Francisco G S; Sarmento José S et al
PHYSICA B-CONDENSED MATTER
DOI 10.1016/j.physb.2024.416634
ISSN 0921-4526
|
PS
Condensed Matter Physics
|
| 2024 |
Artigo em periódico |
Comprehensive analysis of the electronic; thermodynamic; and spectroscopic properties of a Cu(II)-based complex with 1;10-phenanthroline and L-glutamine
Marinaldo Vilar De Souza JUNIOR; Oliveira Neto João G; Pereira Walajhone O; Rodrigues Jéssica A O; Viana Jailton R et al
HELIYON
DOI 10.1016/j.heliyon.2024.e37505
ISSN 2405-8440
|
PS
Physical and Theoretical Chemistry
|
| 2024 |
Artigo em periódico |
structural Design; H-bonding Interactions; Vibrational Properties; Periodic-DFT Calculations; and Antibacterial Activity of a Nicotinamide Cocrystal Using Tetradecanoic Acid as Coformer
João G De Oliveira NETO; Marinaldo Vilar De Souza JUNIOR; Alejandro P AYALA; Carlos E S NOGUEIRA; Eliana B SOUTO et al
CRYSTAL GROWTH & DESIGN
DOI 10.1021/acs.cgd.4c01324
ISSN 1528-7483
|
PS
Physical and Theoretical Chemistry
|
| 2024 |
Artigo em periódico |
Ascorbic Acid; Ascorbate; and Dehydroascorbic Acid as Green Corrosion Inhibitors: A Computational Investigation
Souza Bruno D F; Lage Mateus R; Santos Adenilson Oliveira DOS; Francisco Ferreira De SOUSA; Gester RODRIGO et al
Corrosion and Materials Degradation
DOI 10.3390/cmd5040029
ISSN 2624-5558
|
PS
Physical and Theoretical Chemistry
|
| 2024 |
Artigo em periódico |
Structural and spectroscopic properties; solvation effects; intermolecular interactions; and biological assays of a Mn(II)-complex with 1;10-phenanthroline and chloro ligands
De Souza Junior Marinaldo V; De Oliveira Neto João G; Viana Jailton R; Dutra Richard P; Lage Mateus R et al
VIBRATIONAL SPECTROSCOPY
DOI 10.1016/j.vibspec.2024.103710
ISSN 0924-2031
|
PS
Spectroscopy
|
| 2023 |
Trabalho em evento |
Phenanthroline complexes with Mg2+ and Nd3+ ions: a comprehensive experimental study combined with computational calculations and cytotoxic assays
João Gomes De Oliveira NETO; Jailton Romão VIANA; Jad Lorena Feitosa SIMPLÍCIO; Kamila Rodrigues ABREU; Ana Luíza De Araújo BUTARELLI et al
XXI SBPMat B-MRS
ISBN 978-85-63273-
|
PS
Organic Chemistry
|
| 2023 |
Trabalho em evento |
PROPRIEDADES ESTRUTURAIS; TÉRMICAS E ANÁLISE DE SUPERFÍCIES DE HIRSHFELD DO CRISTAL CLOROBIS(1;10-FENANTROLINA)NITRATO DE COBRE(II) MONOHIDRATADO
Marinaldo Vilar De Souza JUNIOR; João Gomes De Oliveira NETO; Jailton Romão VIANA; Jayson Cabral Dos SANTOS; Jady Gabriely Dos Santos SILVA et al
First North and Northeast International Meeting on Materials Science and Engineering
|
PS
Materials Science (miscellaneous)
|
| 2023 |
Trabalho em evento |
The biodiversity of the Amazon as a source of materials for Experimental Physics
Francisco Ferreira De SOUSA; Daniel Palheta PEREIRA; Sanclayton Geraldo Carneiro MOREIRA
XXXVII Encontro de Física do Norte e Nordeste
|
PS
Physics and Astronomy (miscellaneous)
|
| 2023 |
Trabalho em evento |
ANTIMICROBIAL OF AQUA-(GLUTAMINATO)-(1;10-PHENANTHROLINE)-Cu(II) NITRATE MONOHYDRATE COORDINATION COMPLEX
Marinaldo Vilar De Souza JUNIOR; João Gomes De Oliveira NETO; Telma Fatima Vieira BATISTA; Fernando De Souza SANTOS; Adenilson Oliveira Dos SANTOS et al
First North and Northeast International Meeting on Materials Science and Engineering
|
PS
Electronic; Optical and Magnetic Materials
|
| 2023 |
Trabalho em evento |
Raman; FT-IR; and DFT studies of aqua-(glutaminato)-(1;10-phenanthroline)-copper nitrate monohydrate coordination complex
Marinaldo Vilar De Souza JUNIOR; João Gomes De Oliveira NETO; Ana Beatriz Nunes MOREIRA; Jailton Romão VIANA; Adenilson Oliveira Dos SANTOS et al
XXI SBPMat B-MRS
|
PS
Spectroscopy
|
| 2023 |
Trabalho em evento |
Synthesis; characterization; and anticancer activity of a coordination complex of cobalt(II) with 1;10-phenanthroline and malic acid ligands
Jailton Romão VIANA; João Gomes De Oliveira NETO; Ana L A BUTARELLI; Ana Paula Silva De Azevedo Dos SANTOS; Francisco Ferreira De SOUSA et al
XXI SBPMat B-MRS
|
PS
Organic Chemistry
|
| 2023 |
Artigo em periódico |
Elucidating the phase transitions of decanoic-acid crystal by XRD; Raman; group theory and Gibbs energy analyses combined with DFT calculations
P Gurgel WALLDINEY; Correa ADRIANO; C Santos CLENILTON; O Santos ADENILSON; D Saraiva GILBERTO et al
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
DOI 10.1016/j.saa.2022.122068
ISSN 1386-1425
|
PS
Physical and Theoretical Chemistry
|
| 2023 |
Artigo em periódico |
Pressure-dependence Raman spectroscopy and the lattice dynamic calculations of Bi2(MoO4)3 crystal
Saraiva G D; Ramiro De Castro A J; Teixeira A M R; Sousa Neto V O; Lima J A et al
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
DOI 10.1016/j.saa.2023.122711
ISSN 1386-1425
|
PS
Spectroscopy
|
| 2023 |
Artigo em periódico |
Phase transitions of L-histidinium hydrogen oxalate crystal under high pressures investigated by Raman spectroscopy
Pinho E K S; Silva Filho J G DA; Francisco Ferreira De SOUSA; Freire P T C; Lima J A et al
SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY
DOI 10.1016/j.saa.2023.122800
ISSN 1386-1425
|
PS
Spectroscopy
|
| 2023 |
Artigo em periódico |
Synthesis; characterization; DFT study; and antibacterial activity of a coordination complex of Cu(II) with 1;10-phenanthroline and L-methionine ligands
Rodrigues Jessica A O; Torres Adriano U; De Sousa Natan A B; De Sousa Thallysson J D; Neto João G OLIVEIRA et al
JOURNAL OF MOLECULAR STRUCTURE
DOI 10.1016/j.molstruc.2023.136197
ISSN 0022-2860
|
PS
Organic Chemistry
|
| 2023 |
Artigo em periódico |
New polymorphic phase of arachidic acid crystal: structure; intermolecular interactions; low-temperature stability and Raman spectroscopy combined with DFT calculations
Cardoso Luanny M B; De Oliveira Neto João G; Saraiva Gilberto D; Leite Fábio F; Ayala Alejandro P et al
RSC Advances
DOI 10.1039/d3ra05388a
ISSN 2046-2069
|
PS
Physical and Theoretical Chemistry
|
