المؤلفون: Brahim Lakehal, Abdelghani Dendouga

المصدر: East European Journal of Physics, Iss 2, Pp 431-436 (2024)

مصطلحات موضوعية: solar cell, intermediate-band solar cells, band energy level, series and shunt resistance, absorption coefficients, Physics, QC1-999

وصف الملف: electronic resource

العلاقة: https://periodicals.karazin.ua/eejp/article/view/23356Test; https://doaj.org/toc/2312-4334Test; https://doaj.org/toc/2312-4539Test

الوصول الحر: https://doaj.org/article/687ef2bfe002464797deb298873ed403Test

المؤلفون: Dong Li, Siyu Tian, Qiuhua Qian, Caiyun Gao, Hongfang Shen, Fei Han

المصدر: Molecules, Vol 29, Iss 13, p 3126 (2024)

مصطلحات موضوعية: Cs-doped, tungsten trioxide, oxygen vacancy, band energy, oxygen evolution reaction, Organic chemistry, QD241-441

وصف الملف: electronic resource

العلاقة: https://www.mdpi.com/1420-3049/29/13/3126Test; https://doaj.org/toc/1420-3049Test

الوصول الحر: https://doaj.org/article/8a783d9917dc4269b613ce7246c9a018Test

المؤلفون: Shen, Weicheng, Azmy, Ali, Li, Guang, Mishra, Anamika, Syrgiannis, Zois, Zheng, Wenwen, Volonakis, George, Kepenekian, Mikaël, Even, Jacky, Wojtas, Lukasz, Wang, Cheng, Huang, Lishuai, Chen, Weiqing, Zhou, Shun, Zhou, Jin, Zeng, Guojun, Pu, Dexin, Guan, Hongling, Fang, Guojia, Ke, Weijun, Spanopoulos, Ioannis

المساهمون: Wuhan Institute of Technology (WIT), Wuhan University China, University of South Florida Tampa (USF), Nanoneurosciences LLC, Ecole Nationale Supérieure de Chimie de Rennes (ENSCR), Institut des Sciences Chimiques de Rennes (ISCR), Université de Rennes (UR)-Institut National des Sciences Appliquées - Rennes (INSA Rennes), Institut National des Sciences Appliquées (INSA)-Institut National des Sciences Appliquées (INSA)-Ecole Nationale Supérieure de Chimie de Rennes (ENSCR)-Institut de Chimie - CNRS Chimie (INC-CNRS)-Centre National de la Recherche Scientifique (CNRS), Institut des Fonctions Optiques pour les Technologies de l'informatiON (FOTON), Institut National des Sciences Appliquées (INSA)-Institut National des Sciences Appliquées (INSA)-École Nationale Supérieure des Sciences Appliquées et de Technologie (ENSSAT)-Centre National de la Recherche Scientifique (CNRS), National Natural Science Foundation of China: 12174290, Natural Science Foundation of Hubei Province: 2023AFB679, Institut Universitaire de France, Grand Équipement National De Calcul Intensif: 2022‐A0130907682, ANR-23-CE09-0001,SURFIN,Surfaces et interfaces des nouveaux perovkites et perovskitoides.(2023)

المصدر: ISSN: 1614-6832.

مصطلحات موضوعية: band energy alignment, charge transfer, fullerene-based semiconductors, ideal-bandgap, multifunctional interfaces, perovskite solar cells, [SPI]Engineering Sciences [physics], [CHIM]Chemical Sciences, [CHIM.MATE]Chemical Sciences/Material chemistry

العلاقة: hal-04564542; https://hal.science/hal-04564542Test; https://hal.science/hal-04564542/documentTest; https://hal.science/hal-04564542/file/Shen%20et%20al%20-%202024%20-%20A%20Crystalline%202D%20Fullerene-based%20Metal%20Halide%20Semiconductor%20for%20_Manuscript%202_AA.docx.pdfTest

الإتاحة: https://doi.org/10.1002/aenm.202400582Test
https://hal.science/hal-04564542Test
https://hal.science/hal-04564542/documentTest
https://hal.science/hal-04564542/file/Shen%20et%20al%20-%202024%20-%20A%20Crystalline%202D%20Fullerene-based%20Metal%20Halide%20Semiconductor%20for%20_Manuscript%202_AA.docx.pdfTest

المؤلفون: A. K. M. Moyeenul Huq, Miah Roney, Amit Dubey, Muhammad Hassan Nasir, Aisha Tufail, Mohd Fadhlizil Fasihi Mohd Aluwi, Wan Maznah Wan Ishak, Md. Rabiul Islam, Saiful Nizam Tajuddin

مصطلحات موضوعية: Biophysics, Biochemistry, Pharmacology, Biotechnology, Cancer, Infectious Diseases, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, two mosquito species, possible inhibitory activities, favouravle global softness, density functional theory, band energy gap, potential therapeutic target, potential therapeutic candidate, potential inhibitory activity, theobroma cacao <, molecular charge transfer, aedes albopictus <, aedes aegypti <, 29 phenolic acids, binding pose identified, appropriate admet profiles, +twenty%22">xlink "> twenty, theobroma cacao l, silico drug discovery, reference compound panduratin, %22">xlink ">, silico <

العلاقة: https://figshare.com/articles/journal_contribution/Results_of_the_phenolic_compounds_of_i_Theobroma_cacao_i_L_against_DENV-3_NS5_RdRp_protein_with_their_respective_docking_energy_value_and_interacting_residue_in_the_binding_site_/25408869Test

الإتاحة: https://doi.org/10.1371/journal.pone.0299238.s001Test

المؤلفون: A. K. M. Moyeenul Huq, Miah Roney, Amit Dubey, Muhammad Hassan Nasir, Aisha Tufail, Mohd Fadhlizil Fasihi Mohd Aluwi, Wan Maznah Wan Ishak, Md. Rabiul Islam, Saiful Nizam Tajuddin

مصطلحات موضوعية: Biophysics, Biochemistry, Pharmacology, Biotechnology, Cancer, Infectious Diseases, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, two mosquito species, possible inhibitory activities, favouravle global softness, density functional theory, band energy gap, potential therapeutic target, potential therapeutic candidate, potential inhibitory activity, theobroma cacao <, molecular charge transfer, aedes albopictus <, aedes aegypti <, 29 phenolic acids, binding pose identified, appropriate admet profiles, +twenty%22">xlink "> twenty, theobroma cacao l, silico drug discovery, reference compound panduratin, %22">xlink ">, silico <

العلاقة: https://figshare.com/articles/journal_contribution/Molecular_physicochemical_descriptors_and_drug-likeness_analysis_of_the_selected_compounds_/25408872Test

الإتاحة: https://doi.org/10.1371/journal.pone.0299238.s002Test

المؤلفون: A. K. M. Moyeenul Huq, Miah Roney, Amit Dubey, Muhammad Hassan Nasir, Aisha Tufail, Mohd Fadhlizil Fasihi Mohd Aluwi, Wan Maznah Wan Ishak, Md. Rabiul Islam, Saiful Nizam Tajuddin

مصطلحات موضوعية: Biophysics, Biochemistry, Pharmacology, Biotechnology, Cancer, Infectious Diseases, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, two mosquito species, possible inhibitory activities, favouravle global softness, density functional theory, band energy gap, potential therapeutic target, potential therapeutic candidate, potential inhibitory activity, theobroma cacao <, molecular charge transfer, aedes albopictus <, aedes aegypti <, 29 phenolic acids, binding pose identified, appropriate admet profiles, +twenty%22">xlink "> twenty, theobroma cacao l, silico drug discovery, reference compound panduratin, %22">xlink ">, silico <

العلاقة: https://figshare.com/articles/journal_contribution/Showing_properties_of_atoms_of_the_compound_and_control_/25408878Test

الإتاحة: https://doi.org/10.1371/journal.pone.0299238.s004Test

المؤلفون: A. K. M. Moyeenul Huq, Miah Roney, Amit Dubey, Muhammad Hassan Nasir, Aisha Tufail, Mohd Fadhlizil Fasihi Mohd Aluwi, Wan Maznah Wan Ishak, Md. Rabiul Islam, Saiful Nizam Tajuddin

مصطلحات موضوعية: Biophysics, Biochemistry, Pharmacology, Biotechnology, Cancer, Infectious Diseases, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, two mosquito species, possible inhibitory activities, favouravle global softness, density functional theory, band energy gap, potential therapeutic target, potential therapeutic candidate, potential inhibitory activity, theobroma cacao <, molecular charge transfer, aedes albopictus <, aedes aegypti <, 29 phenolic acids, binding pose identified, appropriate admet profiles, +twenty%22">xlink "> twenty, theobroma cacao l, silico drug discovery, reference compound panduratin, %22">xlink ">, silico <

العلاقة: https://figshare.com/articles/journal_contribution/ADMET_profiling_enlisting_absorption_distribution_metabolism_and_toxicity_related_drug-likeness_parameters_/25408875Test

الإتاحة: https://doi.org/10.1371/journal.pone.0299238.s003Test

المؤلفون: A. K. M. Moyeenul Huq, Miah Roney, Amit Dubey, Muhammad Hassan Nasir, Aisha Tufail, Mohd Fadhlizil Fasihi Mohd Aluwi, Wan Maznah Wan Ishak, Md. Rabiul Islam, Saiful Nizam Tajuddin

مصطلحات موضوعية: Biophysics, Biochemistry, Pharmacology, Biotechnology, Cancer, Infectious Diseases, Biological Sciences not elsewhere classified, Chemical Sciences not elsewhere classified, Information Systems not elsewhere classified, two mosquito species, possible inhibitory activities, favouravle global softness, density functional theory, band energy gap, potential therapeutic target, potential therapeutic candidate, potential inhibitory activity, theobroma cacao <, molecular charge transfer, aedes albopictus <, aedes aegypti <, 29 phenolic acids, binding pose identified, appropriate admet profiles, +twenty%22">xlink "> twenty, theobroma cacao l, silico drug discovery, reference compound panduratin, %22">xlink ">, silico <

العلاقة: https://figshare.com/articles/journal_contribution/Showing_properties_of_bonds_of_the_compound_and_control_/25408881Test

الإتاحة: https://doi.org/10.1371/journal.pone.0299238.s005Test

المؤلفون: A. Gulay V., A. Dubovik V., А. Гулай B., А. Дубовик В.

المصدر: «System analysis and applied information science»; № 1 (2024); 43-49 ; «Системный анализ и прикладная информатика»; № 1 (2024); 43-49 ; 2414-0481 ; 2309-4923 ; 10.21122/2309-4923-2024-1

مصطلحات موضوعية: compositions of rare earth elements, precursors of high-temperature superconductors, first principles modeling, elementary crystal cell, band energy diagram, density of electronic states, соединения редкоземельных элементов, прекурсоры высокотемпературных сверхпроводников, моделирование из первых принципов, элементарная кристаллическая ячейка, зонная энергетическая диаграмма, плотность электронных состояний

وصف الملف: application/pdf

العلاقة: https://sapi.bntu.by/jour/article/view/659/494Test; Швейкин, Г.П. Электронная структура и физико-химические свойства высокотемпературных сверхпроводников / Г.П. Швейкин, В.А. Губанов, А.А. Фотиев, Г.В. Базуев, А.А. Евдокимов. – М.: Наука,1990. – 240 с.; Lundberg, М. Snynthesis and magnetization of BaLn2 O4 (Ln = lanthanide) / М. Lundberg. – Florida: Florida State University Libraries, 2014. – 85 p.; Kresse, G. VASP the GUIDE / G. Kresse, M. Marsman, J. Furthmulle. – Vienna: Universität Wien, 2012. – 188 p.; Gulay, A.V. Ab-initio simulation of electronic features of hyperfine rare earth oxide films for sensory nanosystems / A.V. Gulay, V.M. Koleshko, et al. // Наука и техника. – 2014. – № 3. – С. 11-17.; The Materials Project. BaY2 O4 . [Электронный ресурс]. Режим доступа: https://5896materialsproject.org/materials/mp-3952Test/ Дата доступа: 23.01.2024.; The Materials Project. BaGd2 O4 . [Электронный ресурс]. Режим доступа: https://materialsproject.org/materials/mp-17143Test/ Дата доступа: 17.01.2024.; The Materials Project. BaLu2 O4 . [Электронный ресурс]. Режим доступа: https://materialsproject.org/materials/mp752442Test/ Дата доступа: 19.01.2024.; Sun, J. First-Principles Calculations of Novel Materials / J. Sun. – Florida: Florida State University Libraries, 2015. –166 p.; https://sapi.bntu.by/jour/article/view/659Test

الإتاحة: https://doi.org/10.21122/2309-4923-2024-1-43-67Test
https://doi.org/10.21122/2309-4923-2024-1Test
https://sapi.bntu.by/jour/article/view/659Test

المؤلفون: de Melo, Pedro Miguel M. C., de Abreu, Joao C., Guster, Bogdan, Giantomassi, Matteo, Zanolli, Zeila, Gonze, Xavier, Verstraete, Matthieu

المساهمون: CESAM - Complex and Entangled Systems from Atoms to Materials - ULiège, BE

المصدر: npj Computational Materials, 9 (1) (2023-12)

مصطلحات موضوعية: Band energy, Condensed matter, Degenerate electrons, Electrical resistances, Electron bands, Energy correction, High-throughput analysis, Optical spectrum, Polar materials, Polaron models, Modeling and Simulation, Materials Science (all), Mechanics of Materials, Computer Science Applications, General Materials Science, Physical, chemical, mathematical & earth Sciences, Physics, Physique, chimie, mathématiques & sciences de la terre, Physique

العلاقة: https://www.nature.com/articles/s41524-023-01083-8.pdfTest; urn:issn:2057-3960

الوصول الحر: https://orbi.uliege.be/handle/2268/307256Test