검색결과 : 3건
| No. | Article |
|---|---|
| 1 |
Performance of Electronic Structure Methods for the Description of Huckel-Mobius Interconversions in Extended pi-Systems Woller T, Banerjee A, Sylvetsky N, Santra G, Deraet X, De Proft F, Martin JML, Alonso M Journal of Physical Chemistry A, 124(12), 2380, 2020 |
| 2 |
Minimally Empirical Double-Hybrid Functionals Trained against the GMTKN55 Database: revDSD-PBEP86-D4, revDOD-PBE-D4, and DOD-SCAN-D4 Santra G, Sylvetsky N, Martin JML Journal of Physical Chemistry A, 123(24), 5129, 2019 |
| 3 |
The X40x10 Halogen Bonding Benchmark Revisited: Surprising Importance of (n-1)d Subvalence Correlation Kesharwani MK, Manna D, Sylvetsky N, Martin JML Journal of Physical Chemistry A, 122(8), 2184, 2018 |