Suchergebnisse - "Liu, Sheng"

PubPharm (20)

1

The interaction between H and CH3 of adsorption on the diamond (100)-2 × 1 surface based on DFT Calculations

enthalten in: Journal of molecular modeling | 2022

von Zhang, Y. | Zhang, L. | Zhang, D. | +4

2

The interaction between H and $ CH_{3} $ of adsorption on the diamond (100)-2 × 1 surface based on DFT Calculations

enthalten in: Journal of molecular modeling | 2022

von Zhang, Y. | Zhang, L. | Zhang, D. | +4

3

The interaction between H and $ CH_{3} $ of adsorption on the diamond (100)-2 × 1 surface based on DFT Calculations

enthalten in: Journal of molecular modeling | 2022

von Zhang, Y. | Zhang, L. | Zhang, D. | +4

4

Erratum to: A UB3LYP and UMP2 theoretical investigation on unusual cation-π interaction between the triplet state HB=BH $$ \left( {{}^3\Sigma_g^{-} } \right) $$ and H+, Li+, Na+, Be2+ or Mg2+

enthalten in: Journal of molecular modeling | 2011

von Ren, F. | Ren, J. | Liu, S. | +3

5

Erratum to: A UB3LYP and UMP2 theoretical investigation on unusual cation-π interaction between the triplet state HB=BH $$ \left( {{}^3\Sigma_g^{-} } \right) $$ and $ H^{+} $, $ Li^{+} $, $ Na^{+} $, $ Be^{2+} $ or $ Mg^{2+} $

enthalten in: Journal of molecular modeling | 2010

von Ren, F. | Ren, J. | Liu, S. | +3

6

Erratum to: A UB3LYP and UMP2 theoretical investigation on unusual cation-π interaction between the triplet state HB=BH $$ \left( {{}^3\Sigma_g^{-} } \right) $$ and $ H^{+} $, $ Li^{+} $, $ Na^{+} $, $ Be^{2+} $ or $ Mg^{2+} $

enthalten in: Journal of molecular modeling | 2010

von Ren, F. | Ren, J. | Liu, S. | +3

7

Erratum to: A UB3LYP and UMP2 theoretical investigation on unusual cation-π interaction between the triplet state HB=BH %$ \left( {{}^3\Sigma_g^{-} } \right) %$ and $ H^{+} $, $ Li^{+} $, $ Na^{+} $, $ Be^{2+} $ or $ Mg^{2+} $

enthalten in: Journal of molecular modeling | 2010

von Ren, F. | Ren, J. | Liu, S. | +3

8

A UB3LYP and UMP2 theoretical investigation on unusual cation-pi interaction between the triplet state HB=BH (3 Sigma g-) and H+, Li +, Na +, Be 2+ or Mg 2+

enthalten in: Journal of molecular modeling | 2010

von Ren, F. | Ren, J. | Liu, S. | +3

ErratumIn: J Mol Model. 2010 Apr;16(4):823

9

A B3LYP and MP2 theoretical investigation into host-guest interaction between calix[4]arene and Li(+) or Na (+)

enthalten in: Journal of molecular modeling | 2010

von Cao, D. | Ren, F. | Feng, Y. | +2

10

QSPR modeling of thermal stability of nitroaromatic compounds: DFT vs. AM1 calculated descriptors

enthalten in: Journal of molecular modeling | 2010

von Xu, W. | Ren, F. | Ren, J. | +4