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Works matching IS 1432881X AND DT 2025 AND VI 144 AND IP 3

Results: 4

1

First-principles calculations of lightly Ga-doped monocrystalline silicon grown by Czochralski method.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 3, p. 1, doi. 10.1007/s00214-025-03179-4

By:

Fang, Congcong;
Meng, Bin;
Lv, Guoqiang;
Yu, Xiaohua;
Lu, Xing;
Zeng, Weixin

Publication type:

Article

2

Structures, electronic, and magnetic properties of transition metal-loaded metal–organic frameworks with different linkers.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 3, p. 1, doi. 10.1007/s00214-025-03178-5

By:

Yang, Shu-Qi;
Li, Zhi;
Yin, Jia-Hui;
Zhao, Zhen

Publication type:

Article

3

QTAIM analysis of the bonding in tri-osmium cluster [(μ-Cl))Os<sub>3</sub>(μ<sub>2</sub>-σ,π-CH = CH<sub>2</sub>)(CO)<sub>10</sub>].

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 3, p. 1, doi. 10.1007/s00214-025-03177-6

By:

Al‐Karaawi, Ali Abdulhasan Rasool;
Al‐Ibadi, Muhsen Abood Muhsen

Publication type:

Article

4

Mechanistic and kinetic study on reactions of cycloalkenes and singlet oxygen.

Published in:

Theoretical Chemistry Accounts: Theory, Computation, & Modeling, 2025, v. 144, n. 3, p. 1, doi. 10.1007/s00214-025-03176-7

By:

Mendoza, Guillermo;
Ortiz-Escarza, Jorge M.;
Lagunes, Irene;
Espinoza, César;
Trigos, Ángel;
Medina, Manuel E.

Publication type:

Article