Ushbu ish iqtibos qilgan ishlar

46 ta ish

Ish: Investigation of CO2, NO2, SO2, and H2O Gas Adsorption on Al2O3, TiO2, and SiO2 Surfaces

1. Efficient iterative schemes for<i>ab initio</i>total-energy calculations using a plane-wave basis set

   Georg Kresse, J. Furthmüller

   Maqola199679 iqtibos

   ABIABI:AkademIndex/2026.other.022668

2. A consistent and accurate<i>ab initio</i>parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-Pu

   Stefan Grimme, Jens Antony, Stephan Ehrlich +1

   Maqola201076 iqtibos

   ABIABI:AkademIndex/2026.other.024826

3. Projector augmented-wave method

   Peter E. Blöchl

   Maqola199449 iqtibos

   ABIABI:AkademIndex/2026.other.022623

4. From ultrasoft pseudopotentials to the projector augmented-wave method

   Georg Kresse, Daniel P. Joubert

   Maqola199949 iqtibos

   ABIABI:AkademIndex/2026.other.022625

5. <i>Ab initio</i>molecular dynamics for liquid metals

   Georg Kresse, J. Häfner

   Maqola199325 iqtibos

   ABIABI:AkademIndex/2026.other.146751

6. Physisorption Behaviors of Organochlorine Pesticides on the InP₃ Monolayer from Theoretical Insight

   Xin Qin, Hao Cui, Qiulan Zhou

   MaqolaOAOchiq kirish20237 iqtibos

   ABIABI:AkademIndex/2026.other.145513

7. Theoretical Study of Gas Sensing toward Acetone by a Single-Atom Transition Metal (Sc, Ti, V, and Cr)-Doped InP₃ Monolayer

   Xin Qin, Hao Cui, Lijuan Guo +2

   Maqola20244 iqtibos

   ABIABI:AkademIndex/2026.other.470375

8. Effects of CO2 pressure on the dynamic wettability of the kerogen surface: Insights from a molecular perspective

   Zhiming Yan, Fengjiao Wang, Yikun Liu +3

   Maqola20254 iqtibos

   ABIABI:AkademIndex/2026.other.836508

9. Intertwining Density Functional Theory and Experiments in the Investigation of Gas Sensing Mechanisms: A Review

   Paulina Powroźnik, Maciej Krzywiecki

   Sharh maqola20253 iqtibos

   ABIABI:AkademIndex/2026.other.337921

10. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845085

11. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845086

12. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845087

13. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845088

14. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845089

15. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845090

16. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845091

17. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845092

18. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845093

19. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845094

20. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845095

21. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845096

22. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845097

23. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845098

24. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845099

25. Sarlavhasiz

    Boshqa1 iqtibos

    ABIABI:AkademIndex/2026.other.845100