DS
| Title | Published in | Access level | OA Policy | Year | Views | Downloads | |
|---|---|---|---|---|---|---|---|
| Modified Density Functional Dispersion Correction for Inorganic Layered MFX Compounds (M = Ca, Sr, Ba, Pb and X = Cl, Br, I) | Journal of Physical Chemistry. A |  | 2020 | 366 | 0 | ||
| Theoretical Study of Halogenated B12H(n)X(12-n)2- (X = F, Cl, Br) | Journal of Physical Chemistry. A | | 2019 | 295 | 65 | ||
| Accurate Computational Thermodynamics Using Anharmonic Density Functional Theory Calculations: The Case Study of B–H Species | ACS Omega |  | 2019 | 523 | 433 | ||
| Correlating Boron-Hydrogen Stretching Frequencies with Boron-Hydrogen Bond Lengths in Closoboranes: An Approach Using DFT Calculations | Helvetica Chimica Acta | | 2018 | 342 | 0 | ||
| Critical evaluation of the effect of anharmonicity and dispersion interactions using density functional theory on structural and spectroscopic properties of selected inorganic compounds | | 2017 | 953 | 489 | |||
| Computational study of the vibrational spectroscopy properties of boron-hydrogen compounds: Mg(B3H8)2, CB9H10− and CB11H12− | International Journal of Hydrogen Energy | | 2017 | 610 | 2 | ||
| A theoretical study of the spectroscopic properties of B2H6 and of a series of BxHyz- species (x = 1-12, y = 3-14, z = 0-2): From BH3 to B12H122- | International journal of hydrogen energy | | 2016 | 722 | 1 | ||
| Theoretical study of B12HnF2-(12-n) species | International journal of hydrogen energy | | 2015 | 637 | 1 | ||
| Isotope Exchange Reactions in Ca(BH4)2 | Journal of physical chemistry. C | | 2015 | 771 | 0 |
