[SIESTA-L] PSEUDO FOR Ce

2005-06-16 Thread Prof.Dr. Kemal ÇOLAKOĞLU
Dear Siesta users, I would appriciate those who send a pseudopotential INPUT for fcc Ce. Kemal Colakoglu,

[SIESTA-L] variation of lattice constants

2005-05-10 Thread Prof.Dr. Kemal ÇOLAKOĞLU
Dear Siesta users and developers, We would like to see the pressure -dependence of elastic constansts on some semiconductors.But for this, firstly we need to calculate the pressure -dependence of lattice constants using Siesta.How can we enter the pressure to see the effect on energy ? Thanks