يعرض 1 - 20 نتائج من 152,641 نتيجة بحث عن '"Activation-Energy"', وقت الاستعلام: 0.51s تنقيح النتائج
  1. 1
    Academic Journal
    Spin-transfer switching dynamics in a two-macrospin-coupled model system.

    المؤلفون: Sun, J. Z.1 (AUTHOR) jonsun@us.ibm.com

    المصدر: Journal of Applied Physics. 1/7/2025, Vol. 137 Issue 1, p1-12. 12p.

    مصطلحات موضوعية: *RECORDS management, *ACTIVATION energy, *DEGREES of freedom, *TEMPERATURE, *PROBABILITY theory, *RANDOM access memory


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  2. 2
    Academic Journal
    Simplification of solvation shell with water clusters in the simulation of electrochemical nitrogen reduction reaction.

    المؤلفون: Liu, Han-Xuan1 (AUTHOR), Huang, Zheng-Qing1 (AUTHOR), Gao, Xin1 (AUTHOR), Yang, Guidong1 (AUTHOR), Chang, Chun-Ran1,2 (AUTHOR) changcr@mail.xjtu.edu.cn

    المصدر: Journal of Chemical Physics. 11/14/2024, Vol. 161 Issue 18, p1-10. 10p.

    مصطلحات موضوعية: *ELECTROLYTIC reduction, *ACTIVATION energy, *SURFACE potential, *WATER use, *SOLVENTS


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  3. 3
    Academic Journal
    Collective molecular-scale carbonation path in aqueous solutions with sufficient structural sampling: From CO2 to CaCO3.

    المؤلفون: Zhu, Xinping1 (AUTHOR), Dupuis, Romain1 (AUTHOR), Pellenq, Roland J.-M.2 (AUTHOR), Ioannidou, Katerina1 (AUTHOR) aikaterini.ioannidou@umontpellier.fr

    المصدر: Journal of Chemical Physics. 11/14/2024, Vol. 161 Issue 18, p1-11. 11p.

    مصطلحات موضوعية: *CARBON dioxide, *ACTIVATION energy, *CARBONATION (Chemistry), *MAGNESIUM carbonate, *CALCIUM carbonate


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  4. 4
    Academic Journal
    Improving the polarization switching properties of wurtzite AlN by introducing IV–IV/AlN superlattice and P-doping.

    المؤلفون: Huang, Mingyue1 (AUTHOR), Duan, Tianpeng1 (AUTHOR), Jiang, Jie1 (AUTHOR), Yang, Qiong1 (AUTHOR) qyang@xtu.edu.cn

    المصدر: Journal of Applied Physics. 11/7/2024, Vol. 136 Issue 17, p1-7. 7p.

    مصطلحات موضوعية: *SWITCHING costs, *ACTIVATION energy, *DENSITY functional theory, *WURTZITE, *ELECTRIC fields


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  5. 5
    Academic Journal
    The effect of chemical doping on the lithiation processes of the crystalline Si anode ‒ A first-principles study.

    المؤلفون: Chiang, Han-Hsin1 (AUTHOR), Pan, Li-Yi1 (AUTHOR), Kuo, Chin-Lung1 (AUTHOR) chinlung@ntu.edu.tw

    المصدر: Journal of Chemical Physics. 8/28/2024, Vol. 161 Issue 8, p1-16. 16p.

    مصطلحات موضوعية: *ACTIVATION energy, *MOLECULAR dynamics, *LITHIATION, *MATERIAL plasticity, *ION energy


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  6. 6
    Academic Journal
    Adaptive accelerated reactive molecular dynamics driven by parallel collective variables overcoming dimensionality explosion.

    المؤلفون: Zhou, Rui1,2,3 (AUTHOR) baoluyao@licp.cas.cn, Bao, Luyao2,4 (AUTHOR) buwf@lzu.edu.cn, Bu, Weifeng1,2,3 (AUTHOR) zhouf@licp.cas.cn, Zhou, Feng2,4 (AUTHOR)

    المصدر: Journal of Chemical Physics. 8/7/2024, Vol. 161 Issue 5, p1-14. 14p.

    مصطلحات موضوعية: *MOLECULAR dynamics, *ACTIVATION energy, *CHEMICAL reactions, *LOW temperatures, *HIGH temperatures


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  7. 7
    Academic Journal
    Curvature-induced enhancement of thermal stability of skyrmions.

    المؤلفون: Silva-Junior, A. G.1 (AUTHOR), Fonseca, J. M.1 (AUTHOR), Costilla, J. I.1 (AUTHOR), Amaral, M. M.1 (AUTHOR), Riveros, A.2 (AUTHOR), Carvalho-Santos, V. L.1 (AUTHOR) vagson.santos@ufv.br

    المصدر: Journal of Applied Physics. 7/28/2024, Vol. 136 Issue 4, p1-9. 9p.

    مصطلحات موضوعية: *ACTIVATION energy, *NANODOTS, *SKYRMIONS, *THERMAL stability, *CURVATURE


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  8. 8
    Academic Journal
    On the quantum dynamical treatment of surface vibrational modes for reactive scattering of H2 from Cu(111) at 925 K.

    المؤلفون: Sah, Mantu Kumar1 (AUTHOR), Naskar, Koushik1 (AUTHOR), Adhikari, Satrajit1 (AUTHOR) pcsa@iacs.res.in, Smits, Bauke2 (AUTHOR), Meyer, Jörg2 (AUTHOR), Somers, Mark F.2 (AUTHOR)

    المصدر: Journal of Chemical Physics. 7/7/2024, Vol. 161 Issue 1, p1-10. 10p.

    مصطلحات موضوعية: *COPPER, *ACTIVATION energy, *DENSITY functional theory, *SURFACE temperature, *PHONONS


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  9. 9
    Academic Journal
    From 2e− to 4e− pathway in the alkaline oxygen reduction reaction on Au(100): Kinetic circumvention of the volcano curve.

    المؤلفون: Li, Yuke1 (AUTHOR) yachen@ustc.edu.cn, Liu, Bing-Yu2 (AUTHOR) zfliu@cuhk.edu.hk, Chen, Yanxia2 (AUTHOR), Liu, Zhi-Feng1,3 (AUTHOR)

    المصدر: Journal of Chemical Physics. 6/28/2024, Vol. 160 Issue 24, p1-11. 11p.

    مصطلحات موضوعية: *OXYGEN reduction, *ACTIVATION energy, *STANDARD hydrogen electrode, *VOLCANOES, *CHARGE exchange, *CURVES


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  10. 10
    Academic Journal
    Atomistic insights from DFT calculations into the catalytic properties on ceria-lanthanum clusters for methane activation.

    المؤلفون: Peraça, Carina S. T.1 (AUTHOR), Bittencourt, Albert F. B.1 (AUTHOR), Bezerra, Raquel C.2 (AUTHOR), Da Silva, Juarez L. F.1 (AUTHOR) juarez_dasilva@iqsc.usp.br

    المصدر: Journal of Chemical Physics. 6/28/2024, Vol. 160 Issue 24, p1-13. 13p.

    مصطلحات موضوعية: *CERIUM oxides, *ACTIVATION energy, *CHEMICAL species, *DENSITY functional theory, *METHANE, *SOLID oxide fuel cells, *DEHYDROGENATION


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  11. 11
    Academic Journal
    Hydrothermal Treatment Effectively Inhibits the Conversion of Rutin to Quercetin in Flos Sophorae Immaturus Compared With Dry Heating: Based on Degrading Kinetic Analysis.

    المؤلفون: Gong, Yuhong1,2 (AUTHOR), Zhao, Yuanyuan1 (AUTHOR), Wang, Dan1 (AUTHOR), Fan, Liuping2 (AUTHOR), Zhao, Xiaoyan1 (AUTHOR) zhaoxiaoyan002@126.com

    المصدر: Journal of Food Process Engineering. Dec2024, Vol. 47 Issue 12, p1-12. 12p.

    مصطلحات موضوعية: ACTIVATION energy, POLYPHENOLS, RUTIN, QUERCETIN, PHENOLS


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  12. 12
    Academic Journal
    The Peierls stress of interfacial dislocation under lattice mismatches.

    المؤلفون: Zhang, Shujun

    المصدر: Journal of Applied Physics; 1/14/2025, Vol. 137 Issue 2, p1-8, 8p

    مصطلحات موضوعية: DISLOCATION structure, INTERFACIAL stresses, HETEROJUNCTIONS, ACTIVATION energy


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  13. 13
    Academic Journal
    Full-dimensional accurate potential energy surface and dynamics for the unimolecular isomerization reaction CH3NC ⇌ CH3CN.

    المؤلفون: Li, Junlong, Li, Junhong, Li, Jun

    المصدر: Journal of Chemical Physics; 1/7/2025, Vol. 162 Issue 1, p1-10, 10p

    مصطلحات موضوعية: POTENTIAL energy surfaces, CHEMICAL kinetics, UNIMOLECULAR reactions, ACTIVATION energy, ATMOSPHERIC chemistry


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  14. 14
    Academic Journal
    Revisiting Thomson's model with multiply charged superfluid helium nanodroplets.

    المؤلفون: García-Alfonso, Ernesto, Ancilotto, Francesco, Barranco, Manuel, Cargnoni, Fausto, Halberstadt, Nadine, Pi, Martí

    المصدر: Journal of Chemical Physics; 12/14/2024, Vol. 161 Issue 22, p1-12, 12p

    مصطلحات موضوعية: COULOMB explosion, IONS, DENSITY functional theory, ACTIVATION energy, HELIUM


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  15. 15
    Academic Journal
    Integrating path sampling with enhanced sampling for rare-event kinetics.

    المؤلفون: Ray, Dhiman

    المصدر: Journal of Chemical Physics; 12/14/2024, Vol. 161 Issue 22, p1-9, 9p

    مصطلحات موضوعية: DENATURATION of proteins, FREE surfaces, ACTIVATION energy, BIOLOGICAL systems, PEPTIDES


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  16. 16
    Academic Journal
    Structural, dielectric, impedance, and ferroelectric studies of LiNbO3-doped K0.5Na0.5NbO3 ceramics.

    المؤلفون: Kumar, Raju, Singh, Satyendra

    المصدر: Journal of Applied Physics; 12/7/2024, Vol. 136 Issue 21, p1-9, 9p

    مصطلحات موضوعية: FERROELECTRIC materials, PERMITTIVITY, DIELECTRIC materials, FERROELECTRIC crystals, ACTIVATION energy, FERROELECTRIC ceramics


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  17. 17
    Academic Journal
    Enhancing ozone catalytic decomposition through acid treatment of α-MnO2 for improved activity and humidity resistance.

    المؤلفون: Xiong, Shangchao1,2 (AUTHOR), Zhang, Kai3 (AUTHOR), Xu, Zhenghao3 (AUTHOR), Ou, Hongjun1 (AUTHOR), Zheng, Yuanyuan1 (AUTHOR), Li, Xi1 (AUTHOR), Peng, Yue2,3 (AUTHOR) pengyue83@tsinghua.edu.cn, Luo, Xubiao3 (AUTHOR), Li, Junhua2 (AUTHOR)

    المصدر: Journal of Environmental Sciences (Elsevier). Mar2025, Vol. 149, p35-45. 11p.

    مصطلحات موضوعية: BRONSTED acids, ACTIVATION energy, ACID catalysts, ACID solutions, ACETIC acid


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  18. 18
    Academic Journal
    A novel method for the remediation of o‐ and p‐aminophenol from industrial wastewater by hexacyanoferrate (III) ions using Ir‐complex catalyst.

    المؤلفون: Goel, Anjali1 (AUTHOR), Rani, Monika1 (AUTHOR) monikatyagi1384@gmail.com

    المصدر: Environmental Quality Management. Sep2024, Vol. 34 Issue 1, p1-9. 9p.

    مصطلحات موضوعية: *POLLUTANTS, ACTIVATION energy, CATALYTIC oxidation, WATER pollution, SEWAGE


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  19. 19
    Academic Journal
    Effect of beeswax and petroleum wax on the thermal degradation behavior, kinetics, and thermodynamics of low‐grade coal.

    المؤلفون: Behera, Pragyandeepti1 (AUTHOR), Mahapatra, Pabitra Mohan1 (AUTHOR), Sabat, Gayatri1 (AUTHOR), Panda, Achyut K.1 (AUTHOR) achyut.panda@gmail.com

    المصدر: Environmental Quality Management. Sep2024, Vol. 34 Issue 1, p1-10. 10p.

    مصطلحات موضوعية: THERMAL coal, ACTIVATION energy, BEESWAX, ENERGY dissipation, THERMODYNAMICS


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  20. 20
    Academic Journal
    Doubling down on density-functional theory.

    المؤلفون: Becke, Axel D.1 (AUTHOR) axel.becke@dal.ca

    المصدر: Journal of Chemical Physics. 12/28/2023, Vol. 159 Issue 24, p1-6. 6p.

    مصطلحات موضوعية: *ACTIVATION energy, *DATABASES, *THERMOCHEMISTRY


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