[SIESTA-L] [***Posible SPAM***]Documents

2013-09-24 Por tôpico enrique martinez
Hi, Did you receive the documents which I have sent earlier? If not, I have re-uploaded them on my Google drive. Click Here, I will upload rest of the documents soon. Regards,

Re: [SIESTA-L] error(bsse)

2013-09-24 Por tôpico Mahmoud Hammouri
Use this: http://vergil.chemistry.gatech.edu/notes/cp.pdf Mahmoud On Sep 24, 2013, at 3:23, "Hamidreza Balangi" mailto:hamidrezabala...@yahoo.com>> wrote: hi Please about The Basis Set Superposition Error (BSSE) when Adsorption occurs molecules on graphene sheet, guide me how to solve it. Thi

[SIESTA-L] error(bsse)

2013-09-24 Por tôpico Hamidreza Balangi
hi Please about The Basis Set Superposition Error (BSSE) when Adsorption occurs molecules on graphene sheet,  guide me how to solve it. This error caused an unusual increase in the absorbed energy is siesta. Regards. hamidreza balangi

[SIESTA-L] error(bsse)

2013-09-24 Por tôpico Hamidreza Balangi
hi Please about The Basis Set Superposition Error (BSSE) when Adsorption occurs molecules on graphene sheet,  guide me how to solve it. This error caused an unusual increase in the absorbed energy is siesta. Regards. hamidreza balangi