Harvey, Jeremy,

Computational chemistry / Jeremy Harvey. - Oxford : Oxford University Press, 2018 - ix, 139 p. : illustrations ; 25 cm. - Oxford chemistry primers .

Includes index.

1: Computation and Computers in Chemistry2: Quantum Chemistry3: Quantum Chemical Methods4: Molecular Mechanics Methods5: Geometry Optimization6: Dynamics Methods7: Rate Constants and Equilibria8: Hybrid and Multi-Scale Methods9: Conclusions

9780198755500 (pbk)


Chemistry--Data processing.
Chemistry--Data processing.
Computational chemistry

542.85 / H2621