Cyclo[16]carbon through the lens of density functional theory: Role of impurity decoration in hydrogen evolution reaction

International Journal of Hydrogen Energy, Год журнала: 2024, Номер 71, С. 400 - 410

Опубликована: Май 22, 2024

Язык: Английский

---

The possibility of using the Zn (II) Butadiyne-linked porphyrin nanoring for detection and adsorption of AsH3, NO2, H2O, SO2, CS2, CO, and CO2 gases

Computational and Theoretical Chemistry, Год журнала: 2024, Номер 1241, С. 114829 - 114829

Опубликована: Авг. 25, 2024

Язык: Английский

---

Utilizing the carbon nano-belt (8-CNB) loaded late second-row transition metal (TM) single-atom catalysts for hydrogen and oxygen evolution during water electrolysis

Materials Science in Semiconductor Processing, Год журнала: 2024, Номер 187, С. 109139 - 109139

Опубликована: Ноя. 25, 2024

Язык: Английский

---

Exploration of hydrogen evolution reaction (HER) by using first row transition metals doped B6 complexes as support materials

Inorganic Chemistry Communications, Год журнала: 2024, Номер 172, С. 113672 - 113672

Опубликована: Дек. 6, 2024

Язык: Английский

---

Hydrogen binding on the B36 borophene nanoflake decorated with first row transition metal atoms: DFT, QTAIM and AIMD study

FlatChem, Год журнала: 2024, Номер unknown, С. 100799 - 100799

Опубликована: Дек. 1, 2024

Язык: Английский

---