thanks for your reply. with your suggestion that solve . best regards.
________________________________ From: "[email protected]" <[email protected]> To: somayeh fotohi <[email protected]> Cc: [email protected] Sent: Wednesday, May 29, 2013 10:43 AM Subject: Re: [SIESTA-L] plot charge density and wave function Dear Somayeh Fotohi: In XCrySDen, you select in menu File -> Open Structure -> Gaussian98 Cube File and read in your .cube For the rest, check the XCrySDen documentation. Good luck Andrei Postnikov > > Dear siesta users, > > > I m > trying to plot charge density and wave function in 3D. > For > this I do: > 1- Run > siest.fdf for obtaining the files required by denchar program > such as (. DM. DIM. PLD. > WSF) .ion of each species . 2- Run denchar.fdf program ( mode of > representation ( 3D).)by denchar denchar.fdf I obtain many file such as > .PHASE.cube, REAL.cube, IMAG.cube, .DRHO.cube, .RHO.cube, …. but I dont > know how to visualize by xcrysden correctly. Please help me. I look > forward to your kindly reply and suggestion. Best Regards, somayeh fotoohi
