Messages by Thread
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[Wien] finding density of states for individual bands
Joseph Ross
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[Wien] NOMAD and Wien2k
Pavel Ondračka
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[Wien] format of case.klist_band
Marcus Ekholm
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[Wien] LAPW1 error
Riyajul Islam
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[Wien] View structure in a remote machine
delamora
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Re: [Wien] Wien post from l...@sz.tsinghua.edu.cn
Peter Blaha
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[Wien] query regarding c/a optimization curve
shamik chakrabarti
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[Wien] external magnetic field using orb with spin-orbit interaction
Mikhail Nestoklon
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[Wien] How to set a specific spin state
Yfding
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[Wien] BoltzTrap
Karima Karim
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Re: [Wien] Option 8 in x optimize
Peter Blaha
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Re: [Wien] To count the no. of atom if occupancy is 0.5 - reg
Peter Blaha
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[Wien] Problem faced during elastic constant calculation using Elast package.
upasana Rani
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[Wien] monoclinic optimization
karima Physique
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[Wien] Optimization of orthorhombic and monoclinic structure.
Ramsewak Kashyap
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[Wien] Occupying high energy states without FERMI error
Guoping Zhang
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[Wien] Berrypi_GGA+U+SO
tarek
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[Wien] parallel instalation of Wien2k: elpa, fftw
Ilias Miroslav, doc. RNDr., PhD.
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Israel Omar Perez Lopez
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Pavel Ondračka
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Pavel Ondračka
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Gavin Abo
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Pavel Ondračka
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Pavel Ondračka
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Ilias Miroslav, doc. RNDr., PhD.
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Peter Blaha
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Ramazan KATIRCI
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Re: [Wien] parallel instalation of Wien2k: elpa, fftw
Laurence Marks
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[Wien] ssh command in Wien2k scripts
Ilias Miroslav, doc. RNDr., PhD.
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[Wien] Segmentation fault in w2w
Niraj Aryal
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[Wien] hyperfine field anisotropic of Li in battery materials
林敏
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[Wien] LAPW1 doesn't show error in parallel calculation
Lyudmila Dobysheva
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[Wien] Exit code "0" for LAPW1 with an error
Rubel, Oleg
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Re: [Wien] electron density maps for several unit cells
Peter Blaha
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[Wien] direct or indirect absorption?
Fan
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[Wien] GGA+U+SO steps order
tarek
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[Wien] Fwd: Regarding the warning in total energy
Subhasis Panda
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[Wien] Born effective charge calculation
Wien2k User
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[Wien] unexpected error in SOC calculations for non spin-polarized case
tarek
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[Wien] wien2wannier and local coordinate systems
Marcus Ekholm
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[Wien] w2wc parallel
karima Physique
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[Wien] Min_lapw Errors
????
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[Wien] join_vectorfiles to be used with a different syntax
Luc Fruchter
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Re: [Wien] dstart.error
Peter Blaha
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[Wien] Ghost band error in anatase TiO2
shamik chakrabarti
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[Wien] omp vs mpi for LAPW1
karima Physique
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[Wien] Error in SCF calculation
upasana Rani
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[Wien] Compiling WIEN2k with AOCL for AMD processors
Artem Tarasov
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[Wien] Continued: Error during abc & gamma (4D) optimization of a monoclinic system
shamik chakrabarti
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[Wien] Berrypi & w2w
Laurence Marks
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[Wien] Interstitial DOS for SOC calculation
Falke, Johannes
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[Wien] Error during abc & gamma (4D) optimization of a monoclinic system
shamik chakrabarti
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[Wien] Lattice thermal conductivity
Peeyush Kumar Kamlesh
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Re: [Wien] Energy in SCF NOT CONVERGED
Sanjay Pachori
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Re: [Wien] how to increase the band gap with TB-MBJ or other potential
Peter Blaha