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Rescue of dead MnO2 for stable electrolytic Zn–Mn redox-flow battery: a metric of mediated and catalytic kinetics.

• Authors : Wang, Qi¹ (AUTHOR); Zhou, Wanhai¹ (AUTHOR) ; Zhang, Yanyan¹ (AUTHOR)

Subjects: *DENSITY functional theory; *ENERGY density; *ENERGY storage

• Source: National Science Review. Aug2024, Vol. 11 Issue 8, p1-10. 10p.

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Multiple mutations in RNA polymerase β-subunit gene (rpoB) in Streptomyces incarnatus NRRL8089 enhance production of antiviral antibiotic sinefungin: modeling rif cluster region by density functional theory.

• Authors : Ogawa, Saori; Shimidzu, Hitomi; Fukuda, Koji

Subjects: DENSITY functional theory; RNA polymerases; MOLECULAR dynamics

• Source: Bioscience, Biotechnology & Biochemistry; May2021, Vol. 85 Issue 5, p1275-1282, 8p

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Orbital-free density functional theory: Differences and similarities between electronic and nuclear systems.

• Authors : Colò, Gianluca; Hagino, Kouichi

Subjects: DENSITY functional theory; ELECTRONIC systems; NUCLEAR physics

• Source: Progress of Theoretical & Experimental Physics: PTEP; Oct2023, Vol. 2023 Issue 10, p1-11, 11p

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Isolation and structural elucidation of novel fusicoccan dehydroxypericonicin A from Roussoella sp.

• Authors : Hayasaka, Ayane¹ (AUTHOR); Tanaka, Kazuaki¹ (AUTHOR); Hashimoto, Masaru¹ (AUTHOR)

Subjects: *DENSITY functional theory; *CIRCULAR dichroism

• Source: Bioscience, Biotechnology & Biochemistry. Aug2021, Vol. 85 Issue 8, p1798-1801. 4p.

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Synthesis and characterization of a chiral spirobifluorene cyclic hexamer.

• Authors : Kobayashi, Seika; Nakazono, Rina; Okada, Rikito

Subjects: MACROCYCLIC compounds; MAGNETIC resonance; FLUORESCENCE

• Source: Bulletin of the Chemical Society of Japan; Oct2024, Vol. 97 Issue 10, p1-6, 6p

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An all-metallic nanovesicle for hydrogen oxidation.

• Authors : Zhang, Juntao; Jin, Lujie; Sun, Hao

Subjects: HYDROGEN oxidation; ROTATING disk electrodes; BIOMIMETICS

• Source: National Science Review; Jun2024, Vol. 11 Issue 6, p1-10, 10p

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Structure transformation from Sierpiński triangles to chains assisted by gas molecules.

• Authors : Li, Chao^1,2 (AUTHOR); Xu, Zhen¹ (AUTHOR); Zhang, Yajie¹ (AUTHOR)

Subjects: *SCANNING tunneling microscopy; *DENSITY functional theory; *SCANNING probe microscopy

• Source: National Science Review. Jul2023, Vol. 10 Issue 7, p1-8. 8p.

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Applied Science & Technology Full Text (H.W. Wilson)

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Rapid quantification of acid value in frying oil using iron tetraphenylporphyrin fluorescent sensor coupled with density functional theory and multivariate analysis.

• Authors : (顾海洋), Haiyang Gu; (董艺凝), Yining Dong; (吕日琴), Riqin Lv

Subjects: METALLOPORPHYRINS; TETRAPHENYLPORPHYRIN; MULTIVARIATE analysis

• Source: Food Quality & Safety; 2022, Vol. 6, p1-11, 11p

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Engineering surface framework TiO6 single sites for unprecedented deep oxidative desulfurization.

• Authors : Yu, Shen; Liu, Zhan; Lyu, Jia-Min

Subjects: SULFUR compounds; TITANIUM catalysts; DESULFURIZATION

• Source: National Science Review; May2024, Vol. 11 Issue 5, p1-12, 12p

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