Estimation of molecular acidity via electrostatic potential at the nucleus and valence natural atomic orbitals. [electronic resource]
- The journal of physical chemistry. A Apr 2009
- 3648-55 p. digital
Publication Type: Journal Article; Research Support, N.I.H., Extramural; Research Support, U.S. Gov't, Non-P.H.S.
1520-5215
10.1021/jp811250r doi
Hydrogen-Ion Concentration Organic Chemicals--chemistry Quantum Theory Static Electricity