About POPLE J A
About Carnegie Mellon Univ., PA, USA
About GILL P M W
About Carnegie Mellon Univ., PA, USA
About JOHNSON B G
About Carnegie Mellon Univ., PA, USA
About Chemical Physics Letters
About molecular orbital method
About Hessian
About Electronic structure of molecules
About 基底関数系
About SHAM
About 密度汎関数理論