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Effect of basis sets on ab initio SCF calculations of molecular hardness
Effect of basis sets on ab initio SCF calculations of molecular hardness
1994
Sudip Nath
A.B. Sannigrahi
Pratim K. Chattaraj
Keywords:
Computational chemistry
Photochemistry
Ab initio
Hydrofluoric acid
Carbon monoxide
Electron affinity
Ionization energy
Ammonia
Ab initio quantum chemistry methods
Chemistry
Inorganic chemistry
Phosphine
Hydrochloric acid
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