| |
| 2009 | ||
|---|---|---|
| 5 | EE | Lingchun Song, Jinshuai Song, Yirong Mo, Wei Wu: An efficient algorithm for energy gradients and orbital optimization in valence bond theory. Journal of Computational Chemistry 30(3): 399-406 (2009) |
| 2007 | ||
| 4 | EE | John Frederick Beck, Yirong Mo: How resonance assists hydrogen bonding interactions: An energy decomposition analysis. Journal of Computational Chemistry 28(1): 455-466 (2007) |
| 2005 | ||
| 3 | EE | Lingchun Song, Yirong Mo, Qianer Zhang, Wei Wu: XMVB: A program for ab initio nonorthogonal valence bond computations. Journal of Computational Chemistry 26(5): 514-521 (2005) |
| 2000 | ||
| 2 | EE | Yirong Mo, Jiali Gao: Ab initio QM/MM simulations with a molecular orbital-valence bond (MOVB) method: application to an SN2 reaction in water. Journal of Computational Chemistry 21(16): 1458-1469 (2000) |
| 1999 | ||
| 1 | EE | Taijin Zhou, Yirong Mo: General method for symmetry orbitals and tensors in electronic structure calculations. Journal of Computational Chemistry 20(3): 305-321 (1999) |
| 1 | John Frederick Beck | [4] |
| 2 | Jiali Gao | [2] |
| 3 | Jinshuai Song | [5] |
| 4 | Lingchun Song | [3] [5] |
| 5 | Wei Wu | [3] [5] |
| 6 | Qianer Zhang | [3] |
| 7 | Taijin Zhou | [1] |