Works about PHYSICAL & theoretical chemistry

Results: 5000

Dynamic oxygen-redox evolution of cathode reactions based on the multistate equilibrium potential model.

Published in:

NPJ Computational Materials, 2025, v. 11, n. 1, p. 1, doi. 10.1038/s41524-025-01714-2

By:

Ran, Nian;
Li, Chengbo;
Cui, Qinwen;
Xue, Dezhen;
Liu, Jianjun

Publication type:

Article

DFT Investigation of Electronic Structure, Reactivity, and Molecular Interactions in a Selenate–Selenite System.

Published in:

Russian Journal of General Chemistry, 2025, v. 95, n. 6, p. 1543, doi. 10.1134/S1070363225602091

By:

Yankova, R.;
Yotova, Ts.;
Avramov, M.

Publication type:

Article

Hydrothermal Synthesis and Characterization of Bifunctional Zeolite Catalysts for Methane Conversion to Gasoline.

Published in:

Russian Journal of General Chemistry, 2025, v. 95, n. 6, p. 1511, doi. 10.1134/S1070363225601905

By:

Kaswan, P.

Publication type:

Article

Three-Dimensional Nanostructure of N-Doped Fe–C from Metal-Organic Framework for Efficient Oxygen Reduction Reaction.

Published in:

Russian Journal of General Chemistry, 2025, v. 95, n. 6, p. 1455, doi. 10.1134/S1070363225601553

By:

Chen, X.;
Xiu, X.;
Zhuang, X.;
Sun, H.;
Dong, C.

Publication type:

Article

Extraction of REE(III) with Mixtures of Bis(diphenylphosphine)quinoxaline Dioxide and Dinonylnaphthalenesulfonic Acid from Nitric Acid Solutions.

Published in:

Russian Journal of General Chemistry, 2025, v. 95, n. 6, p. 1378, doi. 10.1134/S1070363225600948

By:

Turanov, A. N.;
Karandashev, V. K.;
Artyushin, O. I.;
Smirnova, E. V.;
Brel, V. K.

Publication type:

Article

SPA-PNN ligand for the kinetic resolution of carbocyclic and heterocyclic spiranes by asymmetric hydrogenation.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61360-6

By:

Li, Yong-Yao;
Lu, Ka;
Yang, Ju-Song;
Zhang, Xiao-Ming;
Zhang, Fu-Min;
Tu, Yong-Qiang

Publication type:

Article

Effect of solvent-induced packing transitions on N-capped diphenylalanine peptide crystal growth.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61331-x

By:

Dan, Yoav;
Arnon, Zohar A.;
Tang, Yiming;
Kravikass, Mathar;
Zhou, Yun;
Misra, Rajkumar;
Tiwari, Om Shanker;
Shimon, Linda J. W.;
Beck, Roy;
Gazit, Ehud;
Wei, Guanghong;
Adler-Abramovich, Lihi

Publication type:

Article

Near infrared sensitized exciton upconversion luminescence from inorganic perovskite nanocrystals.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61293-0

By:

Zhang, Yiyan;
Zhao, Tianyu;
Deng, Yuming;
Liu, Xinyue;
Zhang, Xiaorong;
Zhu, Tong;
Ågren, Hans;
Chen, Guanying

Publication type:

Article

Superacid counteranion as flexible-coordinating ligand for asymmetric organo-bismuth catalysis.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61265-4

By:

Park, Jin Hyun;
Yoo, Seok Yeol;
Shin, Myoung Hyeon;
Jeong, Sungwook;
Park, Yoonsu;
Bae, Han Yong

Publication type:

Article

In situ stabilization of Cu+ for CO2 Electroreduction via Environmental-molecules-induced ZnO1-x shield.

Published in:

Nature Communications, 2025, v. 16, n. 1, p. 1, doi. 10.1038/s41467-025-61189-z

By:

Zhang, Fanxing;
Cao, Ning;
Wang, Chentao;
Wang, Shengxiang;
He, Yi;
Shi, Yao;
Yan, Mi;
Bao, Ying;
Li, Zhenglong;
Xie, Pengfei

Publication type:

Article

Understanding the interactions of residual chemical fertilizers with vitamin B3 via conductometric and spectroscopic studies.

Published in:

BMC Chemistry, 2025, v. 19, n. 1, p. 1, doi. 10.1186/s13065-025-01551-w

By:

Mohapatra, Prachiprava;
Dutta, Tanika;
Panda, Siddhartha;
Singh, Sulochana;
Talukdar, Malabika

Publication type:

Article

Efficient synthesis of N-(ethylcarbamothioyl)-1-naphthamide: X-ray structure, Hirshfeld surface analysis, DFTs, and molecular modelling investigations as selective inhibitor of alkaline phosphatase.

Published in:

BMC Chemistry, 2025, v. 19, n. 1, p. 1, doi. 10.1186/s13065-025-01525-y

By:

Channar, Pervaiz Ali;
Alshahrani, Mohammad Y.;
Saeed, Aamer;
Ejaz, Syeda Abida;
Attaullah, Hafiz Muhammad;
Channar, Sajid Ali;
Qadir, Sher;
Abbas, Qamar;
Flörke, Ulrich;
Hökelek, Tuncer

Publication type:

Article

3D patterned fabric-based wearable micro-supercapacitor operating at high voltage by electrostatic actuation.

Published in:

NPJ Flexible Electronics, 2025, v. 9, n. 1, p. 1, doi. 10.1038/s41528-025-00435-2

By:

Lin, Xiaoping;
Li, Shangbo;
Li, Xiaoyan;
Huang, Xuming;
Jia, Luhua;
Zhang, Wei;
Cai, Zaisheng;
Imanova, Gunel;
Komarneni, Sridhar

Publication type:

Article

Photochemistry of iron-containing secondary organic aerosol is impacted by relative humidity during formation.

Published in:

NPJ Climate & Atmospheric Science, 2025, v. 8, n. 1, p. 1, doi. 10.1038/s41612-025-01109-6

By:

Garner, Natasha M.;
Mahrt, Fabian;
Top, Jens;
Tadei, Virginia;
Kilchhofer, Kevin;
Takahama, Satoshi;
El Haddad, Imad;
Bell, David M.;
Ammann, Markus;
Alpert, Peter A.

Publication type:

Article

Ultrasonic-Assisted Dealumination of Y Zeolite for Improving VOCs Adsorption and Moisture Resistance.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08186-6

By:

Jang, Younghee;
Kim, Sung Su;
Nguyen, D. Duc

Publication type:

Article

Advances in Mathematical Modelling, Mathematical Optimization and Simulation in Water Treatment.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08159-9

By:

Kiteto, Moses Kayanda;
Mecha, Cleophas Achisa;
Chollom, Martha Noro

Publication type:

Article

Construction of Zinc Oxide/Nickel Ferric-Layered Double Hydroxide Composite for Efficient Adsorption of Erythromycin: Kinetic and Thermodynamic Investigation.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08156-y

By:

Hassan, Asaad F.;
El-kott, Attalla F.;
AlShehri, Mohammed A.;
Aldosari, Fahad M.

Publication type:

Article

Decolorization and COD Removal of Direct Sunlight-resistant Black G Dye Wastewater Using Fe/Al-C Micro-electrolysis.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08153-1

By:

Liu, Pengyu;
Yang, Binguo;
Yan, Jiaming;
Chen, Xiaojie

Publication type:

Article

Synthesis, Characterization, and Effective Adsorption of Naproxen Sodium from Wastewater Using Eco-Friendly Gum Acacia-Grafted-Poly(N,N-Dimethylacrylamide)/CoFe2O4 Hydrogel Nanocomposite.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08151-3

By:

Dave, Pragnesh N.;
Bamaniya, Sanjay

Publication type:

Article

Textile Wastewater Treatment for Basic Fuchsin Dye Removal using Highly Efficient Nano Earthenware Clay in Fixed-Bed Reactors.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08155-z

By:

Yadav, Jiten;
Chahal, Surjeet;
Kashyap, Vikas;
Saxena, Kapil;
Kumar, Chandra

Publication type:

Article

Synthesis, Characterisation and Photocatalytic Properties of ZnO/Carbonaceous Gelatin-Based Aerogel Material for Dyes Degradation in Water.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08123-7

By:

Nechchadi, Bouchra;
Naribi, Zineb;
Salhi, Anas;
El Krati, Mohammed;
Tahiri, Soufiane

Publication type:

Article

Efficient Adsorption of Dye Pollutant by Anchoring Zr-MOF@GO Composite Matrix Microspheres: Performance and Mechanism Insights.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08139-z

By:

Ou, Qianhui;
Xiong, Yan;
Chen, Li;
He, Deyong;
Zhou, Chuxiang;
Wang, Lan

Publication type:

Article

Exploring the Visible Light Photocatalytic Efficiency of Sol–Gel Derived Zinc Ferrite: A Comparative Analysis of Nanoparticles and Thin Films.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08133-5

By:

Briche, Samir;
Boutamart, Mustapha;
Abida, Otman;
Nouneh, Khalid;
El Mersly, Lekbira;
Mouchtari, El Mountassir El;
Rafqah, Salah

Publication type:

Article

Enhanced Degradation of Malachite Green Using Zero-Valent Iron Biochar Composite from Edible Mushroom Dregs for Efficient Peroxymonosulfate Activation.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08116-6

By:

Wang, Dandan;
Wu, Han;
Mu, Yinlu

Publication type:

Article

Sustainable Adsorption of Nickel and Chromium from Aqueous Solutions by Plant-Based Adsorbent.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08114-8

By:

Foroushani, Mohammad Yavari;
Foroushani, Ali Yavari;
Yarahmadi, Hossein

Publication type:

Article

Iron- and Zirconium-Modified Nanocellulose Adsorbent: Broad-Range Selectivity Test for Potentially Toxic Elements and Effective Arsenite Removal.

Published in:

Water, Air & Soil Pollution, 2025, v. 236, n. 8, p. 1, doi. 10.1007/s11270-025-08113-9

By:

Shil, Ratul Kumar;
Rahman, Ismail M. M.;
Sakai, Yuto;
Marumoto, Moe;
Rocky, M. Mehedi Hasan;
Endo, Masaru;
Wong, Kuo H.;
Mashio, Asami S.;
Hasegawa, Hiroshi

Publication type:

Article

Hexamethylenedimine functionalized graphene oxide: a promising and supporting carbonaceous electrode material in supercapacitor.

Published in:

Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 19, p. 1, doi. 10.1007/s10854-025-15205-z

By:

Dhore, Mangesh S.;
Ansari, Qurratul Ain Kausar;
Manza, Hirasing T.;
Korde, Vivek B.;
Khot, Suhas;
Malvadkar, Prakash;
Amalraj, Shankar

Publication type:

Article

Zn-doped TiO2 nanoparticles: enhanced catalytic and nonlinear optical properties.

Published in:

Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 19, p. 1, doi. 10.1007/s10854-025-15182-3

By:

Rao, Shreya;
Shilpa, M. P.;
Shetty, Shivakumar Jagadish;
Bhat, Saideep Shirish;
Gummagol, Neelamma Basayya;
Surabhi, Srivathsava;
Gurumurthy, S. C.

Publication type:

Article

Influence of multi-walled carbon nanotubes on structural and linear/nonlinear optical properties of PVA/TiO2 films for flexible optoelectronic devices.

Published in:

Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 19, p. 1, doi. 10.1007/s10854-025-15152-9

By:

El-Nagar, Hoda;
Abd El-sadek, M. S.;
Ibrahim, E. M. M.;
Elnobi, Sahar

Publication type:

Article

Photocatalytic, electrochemical performance and charge storage mechanism of WO3 synthesized by chemical co-precipitation method.

Published in:

Journal of Materials Science: Materials in Electronics, 2025, v. 36, n. 19, p. 1, doi. 10.1007/s10854-025-15135-w

By:

Nair, Sandra P.;
Nayana, D. A.;
George, Nithya S.;
Nandakumar, S.;
Athira, S.;
Jose, Lolly Mariya;
Joseph, Aruna;
Alex, Javeesh;
Manoj, P. K.;
Sajan, D.

Publication type:

Article

Hydrophobic modification of activated carbon using stearyl chloride for enhanced VOCs adsorption under high-humidity conditions.

Published in:

Journal of Materials Science, 2025, v. 60, n. 25, p. 10269, doi. 10.1007/s10853-025-11059-2

By:

Liu, Nan;
Zhang, Ji-guo;
Guo, Ji-feng;
Zhang, Xin;
Ping, Zhao-li;
Wang, Shao-bo;
Fu, Gao-feng;
Chen, Di-ming;
Hu, Jia-jun;
Wang, Wen-Juan;
Li, Ji-xiang

Publication type:

Article

Electrospun poly(acrylonitrile)/lithium perchlorate-grafted MXene composite nanofibrous membrane as polymer electrolyte for energy storage applications.

Published in:

Journal of Materials Science, 2025, v. 60, n. 25, p. 10433, doi. 10.1007/s10853-025-11055-6

By:

Jagan, Mohan;
Dhanasekaran, Aravinth;
Pragalathan, Subalakshmi;
Velmurugan, V.;
Vijayachamundeeswari, S. P.

Publication type:

Article

Corrosion resistance of KH560-modified water-based epoxy cold-sprayed zinc coating.

Published in:

Journal of Materials Science, 2025, v. 60, n. 25, p. 10478, doi. 10.1007/s10853-025-11008-z

By:

Han, Xu;
Liu, Tongyu;
Yu, He;
Zhao, Yunpeng;
Liu, Bao;
Song, Lai;
Kang, Hongda

Publication type:

Article

Impact of Ti4O7 conductive additive in NCM111 cathode for high-performance lithium-ion batteries.

Published in:

Journal of Materials Science, 2025, v. 60, n. 25, p. 10380, doi. 10.1007/s10853-025-11007-0

By:

Wang, Huacheng;
Guo, Biao;
Xiong, Ziqi;
Jian, Xian;
Zhu, Xinghua

Publication type:

Article

Phase transition and lithium conduction of Nb-doped Li7La3Zr2O12 garnet-type electrolytes.

Published in:

Journal of Materials Science, 2025, v. 60, n. 25, p. 10393, doi. 10.1007/s10853-025-11031-0

By:

Luo, Yali;
Dong, Jiaxin;
Yan, Yan;
Liu, Junjie;
Wang, Liang;
Chen, Zi'ang;
Zhang, He

Publication type:

Article

Mechanism of epoxidized isomerized modified biological lubricants and processing performance evaluation.

Published in:

International Journal of Advanced Manufacturing Technology, 2025, v. 139, n. 1, p. 687, doi. 10.1007/s00170-025-15945-6

By:

Zhang, Xiaotian;
Xu, Wenhao;
Zhou, Zongming;
Dong, Lan;
Dai, Jingjie;
Dambatta, Yusuf Suleiman;
Guo, Jiahao;
Yu, Zhengcheng;
Li, Changhe

Publication type:

Article

Study on the milling characteristics of SiCp/Al composites via laser-assisted multi-dimensional ultrasonic machining.

Published in:

International Journal of Advanced Manufacturing Technology, 2025, v. 139, n. 1, p. 1069, doi. 10.1007/s00170-025-15925-w

By:

Xiang, Daohui;
Zhang, Ziyang;
Song, Chaosheng;
Yuan, Zhaojie;
Yang, Shuaikun;
Ma, Mingyang;
Li, Yanqin;
Gao, Guofu;
Tong, Jinglin;
Zhao, Bo

Publication type:

Article

Application of a potential novel hybrid nano-lubricant by simultaneous dispersion of ceramic and metallic NPs in plant oil for eco-benign end milling of Incoloy 925.

Published in:

International Journal of Advanced Manufacturing Technology, 2025, v. 139, n. 1, p. 399, doi. 10.1007/s00170-025-15864-6

By:

Yadav, Shravan Kumar;
Ghosh, Sudarsan;
Sivanandam, Aravindan

Publication type:

Article

Theoretical investigation of reaction mechanisms of CoO+ with propane.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 6, p. 1, doi. 10.1007/s00214-025-03199-0

By:

Liu, Zhaochun;
Fan, Shiyang;
Tranca, Ionut;
Tielens, Frederik

Publication type:

Article

Assessing spin-flip time-dependent density-functional-based tight-binding for describing Z/E photoisomerization reactions.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 6, p. 1, doi. 10.1007/s00214-025-03198-1

By:

Huix-Rotllant, Miquel;
Park, Woojin;
Mazaherifar, Mohsen;
Choi, Cheol Ho

Publication type:

Article

Investigating low-barrier hydrogen-bonded-assisted proton tunneling in Fujikurin A–D molecules: a computational study.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 6, p. 1, doi. 10.1007/s00214-025-03195-4

By:

Nanni, Luca

Publication type:

Article

Bioinorganic Catalyst for Aerobic Oxidation of Hydrocarbons.

Published in:

Inorganic Materials, 2024, v. 60, n. 13, p. 1438, doi. 10.1134/S0020168525700256

By:

Zeynalov, E. B.;
Huseynov, E. R.;
Sharifova, S. K.;
Huseynov, A. B.;
Abdullayeva, F. A.;
Suleimanova, E. I.

Publication type:

Article

Characterization of Titanium Carbide Prepared from Titanium-Containing Concentrate in a Microwave-Assisted Combined Plasma System.

Published in:

Inorganic Materials, 2024, v. 60, n. 13, p. 1415, doi. 10.1134/S0020168525700220

By:

Balakhonov, D. I.;
Nikolenko, S. V.;
Konevtsov, L. A.

Publication type:

Article

Preparation of Gas-Sensing Thin Sr2+-Doped YFeO3 Films.

Published in:

Inorganic Materials, 2024, v. 60, n. 13, p. 1482, doi. 10.1134/S0020168525700232

By:

Kostryukov, V. F.;
Parshina, A. S.;
Mittova, I. Ya.

Publication type:

Article

A Central Role for Troponin C Amino-Terminal α-Helix in Vertebrate Thin Filament Ca 2+ -Activation.

Published in:

Physchem, 2025, v. 5, n. 2, p. 16, doi. 10.3390/physchem5020016

By:

Shi, Yun;
Blackwell, Lauren A.;
Schroy, Ryan K.;
Cleland, B. Max;
Risi, Cristina M.;
Parvatiyar, Michelle S.;
Pinto, Jose R.;
Galkin, Vitold E.;
Chase, P. Bryant

Publication type:

Article

Python-driven impedance profiling on peptide-functionalized biosensor for detection of HIV gp41 envelope protein.

Published in:

3 Biotech, 2025, v. 15, n. 7, p. 1, doi. 10.1007/s13205-025-04400-8

By:

Ezer, Mehmet;
Uygun, Zihni Onur

Publication type:

Article

Influence of the Structural Type of Zeolites on the Physicochemical and Catalytic Properties of NiMo Sulfide Catalysts in the Hydrotreating of Triglyceride Feedstock.

Published in:

Petroleum Chemistry, 2025, v. 65, n. 3, p. 304, doi. 10.1134/S0965544125600900

By:

Vinogradov, N. A.;
Ardakova, E. A.;
Talanova, M. Yu.;
Sinikova, N. A.;
Mustakimova, E. A.;
Pimerzin, A. A.;
Vutolkina, A. V.

Publication type:

Article

Catalytic Properties of Unsupported Catalysts Based on Transition Metal Phosphides in Hydrotreating of Pyrolysis Products of Chlorinated Polymer Wastes.

Published in:

Petroleum Chemistry, 2025, v. 65, n. 3, p. 286, doi. 10.1134/S0965544125600894

By:

Dzhabarov, E. G.;
Petrukhina, N. N.;
Zakharyan, E. M.

Publication type:

Article

CuO/ZnO/Al2O3 Catalyst for High-Performance Conversion of Carbon Monoxide under High Gas Loads.

Published in:

Petroleum Chemistry, 2025, v. 65, n. 3, p. 259, doi. 10.1134/S0965544125600754

By:

Ovchinnikov, N. A.;
Smirnova, A. A.;
Dolotov, G. O.;
Nadtoka, T. E.;
Rumyantsev, R. N.;
Gordina, N. E.

Publication type:

Article

Commercial Production of Bitumen via Oxidation of Vacuum Residue over Iron Catalysts.

Published in:

Petroleum Chemistry, 2025, v. 65, n. 3, p. 298, doi. 10.1134/S0965544125600596

By:

Abbasov, V. M.;
Afandiyeva, L. M.;
Cherepnova, Yu. P.;
Nasibova, G. G.;
Aliyeva, N. M.;
Ahmadbayova, S. F.;
Mammadov, A. M.;
Lyadov, A. S.

Publication type:

Article