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Gaussian lobe program

Gaussian-Lobe Program for Organic Molecules Adapted to Personal Computers by Don Shillady Virginia Commonwealth University Richmond, Virginia 1978, 30 May, 2003... [Pg.384]

Meier and Vogelsangi" described the adaptation of an existing serial Gaussian lobe SCF program to the SUPRENUM system. They described the basic features of the hardware, programming environment, and the user interface. [Pg.250]

Calculations using Gaussian lobe functions (47, 48, 85) are not used in modem program packages. However, since it is not possible to carry out a spreadsheet calculation with higher order Gaussian functions, because the function library of the EXCEL software does not include the derivatives of the Error Function, a simple Gaussian lobe calculation illustrates well the effect of polarization functions. [Pg.222]

See other pages where Gaussian lobe program is mentioned: [Pg.161]    [Pg.271]    [Pg.155]    [Pg.6233]    [Pg.270]    [Pg.146]    [Pg.6232]    [Pg.36]    [Pg.74]    [Pg.418]    [Pg.5]    [Pg.392]    [Pg.485]    [Pg.73]    [Pg.167]    [Pg.522]   
See also in sourсe #XX -- [ Pg.250 ]



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