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I

Itamar Borges

instituto militar de engenharia

22H指数
160论文数
1.6K被引数
收录论文 35
发表时间
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Molecular design and photophysical tuning of iminocoumarin-based D-π-A Dyes: Structure-Property relationships and DSSC performance基于咪唑并香豆素类D-π-A染料的分子设计与光物理调控：构效关系与DSSC性能
errDyes and Pigments
IF4.2
err2026-09-29
err1
PREAI
errRodrigues, Maria Eduarda S.; Leite, Arcano M. B.; da Cunha, Higor O.; Rosa, Nathalia M. P.; de Carvalho, Yuri P. V.; Borges, Amanda de A.; Gomes, Maria Vitoria S. F.; Caldas, Natalia M.; Dornellas, Rafael M.; da Silva, Fernando de C.; Evangelista, Edson; Borges Jr, Itamar; de Barros, Ana Lucia F.; Forezi, Luana da S. M.
err分享
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MEP-CNN: A visual and explainable machine learning framework for explosive molecule classification based on molecular electrostatic potentialsMEP-CNN：一种基于分子静电势的可视化与可解释机器学习框架，用于爆炸物分子分类
errArtificial Intelligence Chemistry
IF0
err2026-05-01
err1
PREAI
errSouza, Rubens C.; Rosa, Nathalia M. P.; Duarte, Julio Cesar; Maximo-Canadas, Matheus; Borges Jr, Itamar
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Exploring Triplet Aromaticity in Azaboracyclooctatetraenes Using New Descriptors Based on Electron Density Partitioning基于电子密度分割的新描述符探索氮硼杂环辛四烯中的三重芳香性
errChemistrySelect
IF2
err2026-01-14
err0
errOAAI
errRosa, Nathalia M. P.; Maximo-Canadas, Matheus; Borges Jr, Itamar
err分享
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Aromaticity Study of Linear and Belt-like Polycyclic Aromatic Hydrocarbons线性与带状多环芳香烃的芳香性研究
errCHEMISTRY-SWITZERLAND
IF2.4
err2025-11-07
err1
PREAI
errSalles, Guilherme A.; Magalhaes, Paulo R. C.; Carvalho, Jhonatas R.; Maximo-Canadas, Matheus; Rosa, Nathalia M. P.; Chagas, Julio C. V.; Ferrao, Luiz F. A.; Aquino, Adelia J. A.; Borges, Itamar; Machado, Francisco B. C.; Lischka, Hans
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Aromaticity of Substituted Benzene Derivatives Employing a New Set of Aromaticity Descriptors Based on the Partition of Electron Density取代苯衍生物的芳香性：采用基于电子密度划分的新芳香性描述符集
errJournal of Computational Chemistry
IF4.8
err2025-11-02
err0
errOAAI
errMatheus Máximo-Canadas; Nathália M. P. Rosa; Itamar Borges Jr
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Consistent set of thermophysical properties of methane curated with machine learning
errPHYSICAL REVIEW E
IF2.4
err2025-10-27
err1
PREAI
errMaximo-Canadas, Matheus; Souza, Rubens Caio; Duarte, Julio Cesar; Nichele, Jakler; Alves, Leonardo Santos de Brito; Pereira, Luiz Octavio Vieira; Franco, Ligia Gaigher; Borges, Itamar
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Interpretable Machine-Learning Models for Predicting Shear Viscosity and Thermal Conductivity of Binary Fluid Mixtures可解释机器学习模型用于预测二元流体混合物的剪切粘度和热导率
errACS Engineering Au
IF5.1
err2025-08-16
err0
errOAAI
errGabriel Braun; Jakler Nichele; Julio Cesar Duarte; Leonardo Alves; Itamar Borges Jr.
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A New Set of Aromaticity Descriptors Based on the Electron Density Employing the Distributed Multipole Analysis (DMA)
errACS OMEGA
IF4.3
err2025-04-01
err0
errOAAI
errMaximo-Canadas, Matheus; Oliveira, Roberta Siqueira Soldaini; Oliveira, Marco Aurelio Souza; Borges Jr, Itamar
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A Systematic and General Machine Learning Approach to Build a Consistent Data Set from Different Experiments: Application to the Thermal Conductivity of Methane一种系统且通用的机器学习方法，用于从不同实验构建一致的数据集：在甲烷热导率中的应用
errACS ENGINEERING AU
IF5.1
err2025-03-11
err1
errOAAI
errMáximo-Canadas, M; Duarte, JC; Nichele, J; Alves, LSD; Pereira, LOV; Ramos, R; Borges, I Jr
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Discovering chemical structure: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAspuru-Guzik, Alan; Bechtel, Tim; Bernales, Varinia; Biggin, Philip C.; Bigi, Filippo; Borges Jr, Itamar; Briling, Ksenia R.; Cheung, Joshua; Collins, Christopher M.; Darmawan, Kevion K.; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Draxl, Claudia; Dyer, Matthew; Eardley-Brunt, Annabel; Evans, Rob; Fairlamb, Ian; Franklin, Barnabas A.; George, Janine; Goulding, Mark; Grundy, Joanna; Hafizi, Roohollah; Hakkennes, Matthijs; Hickey, Niamh; James, Gillian; Juraskova, Veronika; Kalikadien, Adarsh V.; Kapil, Venkat; Kulik, Heather J.; Kumar, Vishank; Kuttner, Christian; Lederbauer, Magdalena; Lou, Yuchen; Mante, Eltjo; Marsh, Liam; Martin, Jennie; Middleton, Clelia; Nematiaram, Tahereh; Pare, Charles W. P.; Pasca, Bianca; Pickard, Chris J.; Ruscic, Branko; Ryder, Matthew R.; Savoie, Brett M.; Sun, Wenhao; Szczypinski, Filip T.; Taniguchi, Takuya; Torrisi, Steven; Vishnoi, Shubham; Walsh, Aron; Wang, Shirui
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Discovering trends in big data: general discussion
errFARADAY DISCUSSIONS
IF3.1
err2025-01-01
err0
PREAI
errAlbornoz, Ricardo Valencia; Antypov, Dmytro; Blanke, Gerd; Borges Jr, Itamar; Bran, Andres Marulanda; Cheung, Joshua; Collins, Christopher M.; David, Nicholas; Day, Graeme M.; Deringer, Volker L.; Draxl, Claudia; Eardley-Brunt, Annabel; Evans, Matthew L.; Fairlamb, Ian; Fieseler, Kate; Franklin, Barnabas A.; George, Janine; Grundy, Joanna; Johal, Jay; Kalikadien, Adarsh V.; Kapil, Venkat; Kotopanov, Lyubomir; Kumar, Vishank; Kuttner, Christian; Lederbauer, Magdalena; Ojeda-Porras, Andrea Carolina; Pang, Jiayun; Parkes, Michael; Pemberton, Miles; Ruscic, Branko; Ryder, Matthew R.; Sakaushi, Ken; Saleh, Gabriele; Savoie, Brett M.; Schwaller, Philippe; Skjelstad, Bastian Bjerkem; Sun, Wenhao; Taniguchi, Takuya; Taylor, Christopher R.; Torrisi, Steven; Vishnoi, Shubham; Walsh, Aron; Wu, Ruiqi
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A density functional theory investigation of the substituent effect on acyclovir and guanine derivatives for applications on energetic materials阿昔洛韦和鸟嘌呤衍生物在含能材料上的取代基效应的密度泛函理论研究
errENERGETIC MATERIALS FRONTIERS
IF3.9
err2024-12-01
err0
errOAAI
errda Silva, Luciana Amorim; Monteiro-de-Castro, Gabriel; Galante, Erick Braga Ferrao; Borges Jr, Itamar; Anastacio, Aline Cardoso
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Ab initio electronic absorption spectra of para-nitroaniline in different solvents: Intramolecular charge transfer effects
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2024-08-30
err1
PREAI
errMaximo-Canadas, Matheus; Modesto-Costa, Lucas; Borges Jr, Itamar
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Photophysical properties of donor (D)-acceptor (A)-donor (D) diketopyrrolopyrrole (A) systems as donors for applications to organic electronic devices
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2024-08-30
err3
PREAI
errRosa, Nathalia M. P.; Borges Jr, Itamar
err分享
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A comprehensive analysis of charge transfer effects on donor-pyrene (bridge)-acceptor systems using different substituents
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2023-08-28
err6
errOAAI
errBorges Jr, Itamar; Guimaraes, Roberta M. P. O.; Monteiro-de-Castro, Gabriel; Rosa, Nathalia M. P.; Nieman, Reed; Lischka, Hans; Aquino, Adelia J. A.
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A Hammett's analysis of the substituent effect in functionalized diketopyrrolopyrrole (DPP) systems: Optoelectronic properties and intramolecular charge transfer effects
errJOURNAL OF COMPUTATIONAL CHEMISTRY
IF4.8
err2023-07-26
err8
PREAI
errMonteiro-de-Castro, Gabriel; Borges, Itamar
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Machine Learning Determination of New Hammett's Constants for meta- and para-Substituted Benzoic Acid Derivatives Employing Quantum Chemical Atomic Charge Methods
errJOURNAL OF ORGANIC CHEMISTRY
IF3.6
err2023-07-11
err12
errOAAI
errMonteiro-de-Castro, Gabriel; Duarte, Julio Cesar; Borges Jr, Itamar
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Non-Kasha fluorescence of pyrene emerges from a dynamic equilibrium between excited states
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2022-10-19
err22
errOAAI
errBraun, Gabriel; Borges Jr, Itamar; Aquino, Adelia J. A.; Lischka, Hans; Plasser, Felix; do Monte, Silmar A.; Ventura, Elizete; Mukherjee, Saikat; Barbatti, Mario
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The generality of the GUGA MRCI approach in COLUMBUS for treating complex quantum chemistry
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2020-04-06
err62
errOAAI
errLischka, Hans; Shepard, Ron; Mueller, Thomas; Szalay, Peter G.; Pitzer, Russell M.; Aquino, Adelia J. A.; Araujo do Nascimento, Mayzza M.; Barbatti, Mario; Belcher, Lachlan T.; Blaudeau, Jean-Philippe; Borges, Itamer; Brozell, Scott R.; Carter, Emily A.; Das, Anita; Gidofalvi, Gergely; Gonzalez, Leticia; Hase, William L.; Kedziora, Gary; Kertesz, Miklos; Kossoski, Fabris; Machado, Francisco B. C.; Matsika, Spiridoula; do Monte, Silmar A.; Nachtigallova, Dana; Nieman, Reed; Oppel, Markus; Parish, Carol A.; Plasser, Felix; Spada, Rene F. K.; Stahlberg, Eric A.; Ventura, Elizete; Yarkony, David R.; Zhang, Zhiyong
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Electronic structure theory gives insights into the higher efficiency of the PTB electron-donor polymers for organic photovoltaics in comparison with prototypical P3HT
errJOURNAL OF CHEMICAL PHYSICS
IF3.1
err2018-11-14
err6
PREAI
errModesto-Costa, Lucas; Borges, Itamar, Jr.; Aquino, Adelia J. A.; Lischka, Hans
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研究方向

暂时未获取到该数据
合作学者
合作期刊
A
Aron Walsh
H 指数: 126 · 论文数: 987
A
Alán Aspuru‐Guzik
H 指数: 114 · 论文数: 938
E
Emily A. Carter
H 指数: 102 · 论文数: 718
C
Chris J. Pickard
H 指数: 92 · 论文数: 512
L
Lin X. Chen
H 指数: 75 · 论文数: 424
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