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Works matching IS 00207608 AND DT 2024 AND VI 124 AND IP 2

Results: 6

1

Adsorption ability of Ga<sub>5</sub>N<sub>10</sub> nanomaterial for removing metal ions contamination from drinking water by DFT.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27348

By:

Mollaamin, Fatemeh;
Monajjemi, Majid

Publication type:

Article

2

From the single‐structure to the multipath approaches: The reactions of the 2‐pentanone with H radical.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27347

By:

Passos, Maiara Oliveira;
Alves, Tiago Vinicius

Publication type:

Article

3

Geometric approach to vertex‐degree‐based topological indices–Elliptic Sombor index, theory and application.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27346

By:

Gutman, Ivan;
Furtula, Boris;
Oz, Mert Sinan

Publication type:

Article

4

Origin of semiconductor and half‐metallic behaviors in the perovskite materials RbXF<sub>3</sub> (X = Co, Mn, Fe or V): A GGA + U approach.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27341

By:

Idrissi, Samira;
Jabar, Abderrahim;
Bahmad, Lahoucine

Publication type:

Article

5

Modulating opto‐electronic and magnetic responses of Mo‐ and Zn‐adsorbed LiNbO<sub>3</sub> (1 1 1) surface for advanced energy harvesting applications: A comprehensive study.

Published in:

International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27335

By:

Rafiq, Qaiser;
Khan, Muhammad Tahir;
Azam, Sikander;
ur Rahman, Amin;
Hayat, Sardar Sikandar;
Alanazi, Yousef Mohammed;
Ahmad, Syed Sheraz

Publication type:

Article

6

Issue Information.

Published in:: International Journal of Quantum Chemistry, 2024, v. 124, n. 2, p. 1, doi. 10.1002/qua.27151
Publication type:: Article