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| Keywords in Publications | |
|---|---|
| keywords | No. of Authors |
| first-principles | 2 |
| actinides | 1 |
| ao-driven | 1 |
| bib o 3 6 | 1 |
| chemical stability | 1 |
| computational modelling | 1 |
| coop | 1 |
| core-polarization potentials | 1 |
| density functional theory | 1 |
| dft | 1 |
| dipole moment | 1 |
| dmrg-casscf | 1 |
| electron correlation | 1 |
| electronic structure theory | 1 |
| equation of motion | 1 |
| equation-of-states | 1 |
| excited state | 1 |
| explicitly correlated coupled-cluster | 1 |
| fe(ii)-porphine | 1 |
| harmonic phononic frequency | 1 |
| lanthanides | 1 |
| lnb o 3 6 | 1 |
| optical property | 1 |
| pseudopotentials | 1 |
| q-chem | 1 |
| quantum chemistry | 1 |
| response theory | 1 |
| second order casscf | 1 |
| software | 1 |
| tribismuth borate | 1 |
| trifluorides | 1 |
| valence basis sets | 1 |
| vibrational mode | 1 |