[SIESTA-L] [***Posible SPAM***]Sin Asunto/Subject is blank

Hello How to solve the Error of (arch.make) during the compilation of Siesta ?! Please Help !! -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)

Re: [SIESTA-L] Siesta parallel version installation on HPC

Hello How to create ans Check an arch.make file?! RCP schrieb am Fr., 24. Juni 2022, 22:07: > Hi, those are routines from the BLAS library, seems you're missing it. > Check your arch.make file. > Bye, > Roberto > > On 22/06/2022 18:14, Ghazanfari, Sarah wrote: > > Hello all, > > > > I am

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Hello all How to run DENCHAR ?! Amal Yassin schrieb am Fr., 24. Juni 2022, 22:18: > Hello > How to create ans Check an arch.make file?! > > > RCP schrieb am Fr., 24. Juni 2022, 22:07: > >> Hi, those are routines from the BLAS library, seems you're missing it. >

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Hello When i run the simulation of Carbone , i existe this error . Any Idea about this error , and how can resolve it ?! Please Help.. Best regard siesta: WARNING: XV file not found siesta: Atomic coordinates (Bohr) and species siesta: 0.0** 3.77945 01 siesta:

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Hello How can resolve "xv File not round" in running ? While i have : UseSaveData T DM.UseSaveDM T -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)

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Hello When i plot the Band of graphene, the Band gap it's not Zero. So what ist the Part of FdF depend of the Band gap? -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)

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Hello When i run pdos.dat for different orbital after change the "m.orbital_chouser.f90" the output is: STOP data array full *How solve this Problem?!* *Please help* -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence

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Dear Siesta Users I make run to carbone nanotube armchair, but i find an error, can anyone helle me to solve this error? ( I added also fdf file here) FDF module: fdf_bline: block_fdf structure not initialized File: fdf.F90 Line: 2803

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Siesta Users I want to find Band structure and DOS for carbone nanotube (in his 2 types). So i have to fdf file, and to know how specify the details of fdf file in 2 types. Know you any Website or tutorials for this project?! Regards -- SIESTA is supported by the Spanish Research Agency (AEI)

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Siesta Users I want to find Band structure and DOS for carbone nanotube (in his 2 types). So i have to fdf file, and to know how specify the details of fdf file in 2 types. Know you any Website or tutorials for this project?! Regards -- SIESTA is supported by the Spanish Research Agency (AEI)

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Users Siesta I want run denchar. I wrote the Flags dépend of it but *.wFSX not found. What is the Problem, if *.WFSX not existe after run fdf file? -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)

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Hello all, I have downloaded an Atom program, but some Atoms are not in it, How do I get their PSf file?! -- SIESTA is supported by the Spanish Research Agency (AEI) and by the European H2020 MaX Centre of Excellence (http://www.max-centre.eu/)

[SIESTA-L] [***Posible SPAM***] Re:

Hi How can make an Access to the executable File, typically located in the Filder./obj ? Best regard. Amal Yassin schrieb am So., 31. Juli 2022, 18:07: > Hello all, > > I have downloaded an Atom program, but some Atoms are not in it, How do I get > their PSf file?! >

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Dear siesta users can you help me? i did the run for fdf file, and i found this error.. coor: Atomic-coordinates input format = Cartesian coordinates coor: (in Angstroms) rcut: Wrong species 3. Have 1 Stopping Program from Node:0 Program