Benchmarking the multipole shielding polarizability / reaction field approach to solvation against QM/MM. Applications to the shielding constants of N-methylacetamide
Research output: Contribution to journal › Journal article › Research › peer-review
Original language | English |
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Journal | Journal of Chemical Physics |
Volume | 134 |
Issue number | 4 |
Pages (from-to) | 044514 |
Number of pages | 11 |
ISSN | 0021-9606 |
DOIs | |
Publication status | Published - 25 Jan 2011 |
- Faculty of Science
Research areas
ID: 32245427