July 2013 Archives by subject

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Starting: Mon Jul 1 15:40:30 CEST 2013
Ending: Wed Jul 31 19:49:00 CEST 2013
Messages: 205

• [Wien] (no subject)   Yasir Ali
• [Wien] (no subject)   Saeid Jalali
• [Wien] (no subject)   jamal sayah
• [Wien] (no subject)   Lyudmila Dobysheva
• [Wien] (no subject)   Yasir Ali
• [Wien] 13 compilation with openmp   Torsten Weissbach
• [Wien] 13 compilation with openmp   Laurence Marks
• [Wien] A bug in qtl f projection   Kim Kyoo
• [Wien] A trick for mpi debugging   Laurence Marks
• [Wien] A trick for mpi debugging   Laurence Marks
• [Wien] A trick for mpi debugging   Luis Ogando
• [Wien] A trick for mpi debugging   Laurence Marks
• [Wien] A trick for mpi debugging   Luis Ogando
• [Wien] Address Error   Karima Karim
• [Wien] Address Error   Gavin Abo
• [Wien] band structure_error in LAPW1   venkatesh chandragiri
• [Wien] band structure_error in LAPW1   Laurence Marks
• [Wien] band structure_error in LAPW1   Peter Blaha
• [Wien] band structure_error in LAPW1   venkatesh chandragiri
• [Wien] Charge density plot   Chang-Jong Kang
• [Wien] Charge density plot   Peter Blaha
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Zaid
• [Wien] Confusion in Selecting proper value of Hubbard potential.   tran at theochem.tuwien.ac.at
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Zaid
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Hong Jiang
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Zaid
• [Wien] Confusion in Selecting proper value of Hubbard potential.   tran at theochem.tuwien.ac.at
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Zaid
• [Wien] Confusion in Selecting proper value of Hubbard potential.   Peter Blaha
• [Wien] Controversy in band gap values CoSb   Peter Blaha
• [Wien] Controversy in band gap values CoSb   Osama Yassin
• [Wien] Controversy in band gap values CoSb   Osama Yassin
• [Wien] Dear W2k users,   Kim Kyoo
• [Wien] Define the direction of magnetization in case.inso for fcc or bcc cubic lattice   Zhu, Jianxin
• [Wien] Define the direction of magnetization in case.inso for fcc or bcc cubic lattice   Peter Blaha
• [Wien] description of case.inst file   saurabh samant
• [Wien] description of case.inst file   Peter Blaha
• [Wien] DOS with GGA+U and SO   pluto at physics.ucdavis.edu
• [Wien] DOS with GGA+U and SO   tran at theochem.tuwien.ac.at
• [Wien] DOS with GGA+U and SO   Fecher, Gerhard
• [Wien] DOS with GGA+U and SO   pluto at physics.ucdavis.edu
• [Wien] DOS with GGA+U and SO   Hong Jiang
• [Wien] DOS with GGA+U and SO   pluto at physics.ucdavis.edu
• [Wien] DOS with GGA+U and SO   Jose Mestnik Filho
• [Wien] DOS with GGA+U and SO   Jose Mestnik Filho
• [Wien] DOS with GGA+U and SO   pluto at physics.ucdavis.edu
• [Wien] DOS with GGA+U and SO   Jose Mestnik Filho
• [Wien] DOS with GGA+U and SO   Jose Mestnik Filho
• [Wien] DOS with GGA+U and SO   pluto at physics.ucdavis.edu
• [Wien] Energie in SCF not converged (MBJ)   gorge mouh
• [Wien] Energie in SCF not converged (MBJ)   Peter Blaha
• [Wien] error   Karima Karim
• [Wien] error   Lyudmila Dobysheva
• [Wien] error   ali betaouaf
• [Wien] error   Hong Jiang
• [Wien] error in copmilation ElaStic_1.0   Rishi Singh
• [Wien] Error in CORE in external field example   Yasir Ali
• [Wien] Error in CORE in external field example   Peter Blaha
• [Wien] Error in CORE in external field example   Yasir Ali
• [Wien] Error in Lapw0   Tuo Cai
• [Wien] Error in mbj (run_lapw -i 80)   mourad boujnah
• [Wien] Error in nn and CORE electrons leak out   Jifeng Sun
• [Wien] Error in nn and CORE electrons leak out   Hong Jiang
• [Wien] Error in nn and CORE electrons leak out   Jifeng Sun
• [Wien] Error in nn and CORE electrons leak out   Laurence Marks
• [Wien] Error in nn and CORE electrons leak out   Jifeng Sun
• [Wien] Error in nn and CORE electrons leak out   Hong Jiang
• [Wien] error in supercell construction for constrained DFT calculation   wasim raja Mondal
• [Wien] error in supercell construction for constrained DFT calculation   wasim raja Mondal
• [Wien] error in supercell construction for constrained DFT calculation   Peter Blaha
• [Wien] error in supercell construction for constrained DFT calculation   wasim raja Mondal
• [Wien] error in supercell construction for constrained DFT calculation   Peter Blaha
• [Wien] error in supercell construction for constrained DFT calculation   pieper
• [Wien] error in wien13 mini/wrtscf.f   Torsten Weissbach
• [Wien] error in wien13 mini/wrtscf.f   Laurence Marks
• [Wien] error in wien13 mini/wrtscf.f   Laurence Marks
• [Wien] error in wien13 mini/wrtscf.f   torsten weissbach
• [Wien] error in wien13 mini/wrtscf.f   Laurence Marks
• [Wien] Error with case.irrepup/dn   venkatesh chandragiri
• [Wien] Exchange functional   wasim raja Mondal
• [Wien] Exchange functional   tran at theochem.tuwien.ac.at
• [Wien] Exchange functional   wasim raja Mondal
• [Wien] Exchange functional   Gavin Abo
• [Wien] extrnal magnetic field effect   majid yazdani
• [Wien] extrnal magnetic field effect   pieper
• [Wien] extrnal magnetic field effect   Peter Blaha
• [Wien] extrnal magnetic field effect   majid yazdani
• [Wien] extrnal magnetic field effect   pieper
• [Wien] extrnal magnetic field effect   Peter Blaha
• [Wien] extrnal magnetic field effect   Peter Blaha
• [Wien] Fwd: band structure dependence on symmetry and complex calculation   venkatesh chandragiri
• [Wien] Fwd: band structure dependence on symmetry and complex calculation   Peter Blaha
• [Wien] Fwd: error in copmilation ElaStic_1.0   Rishi Singh
• [Wien] Fwd: error in copmilation ElaStic_1.0   Gavin Abo
• [Wien] Fwd: error in copmilation ElaStic_1.0   Rishi Singh
• [Wien] geometry option in scfmonitor   tasaka at affinity-science.com
• [Wien] geometry option in scfmonitor   Peter Blaha
• [Wien] Help for applying Hubbard U correction   Mamta Chauhan
• [Wien] Help for applying Hubbard U correction   pieper
• [Wien] Help for applying Hubbard U correction   Mamta Chauhan
• [Wien] Help for applying Hubbard U correction   Rocquefelte
• [Wien] Help for applying Hubbard U correction   pieper
• [Wien] Help Required BandStructure Xmgrace 999   Ali ALLAM
• [Wien] How to calculate optical absorption edge ?   Masood Yousaf
• [Wien] How to calculate optical absorption edge ?   Rocquefelte
• [Wien] How to calculate optical absorption edge ?   Masood Yousaf
• [Wien] How to calculate optical absorption edge ?   Rocquefelte
• [Wien] How to calculate optical absorption edge ?   Masood Yousaf
• [Wien] How to calculate optical absorption edge ?   Rocquefelte
• [Wien] How to calculate optical absorption edge ?   Masood Yousaf
• [Wien] How to check K-points parallel installation   Muhammad Sajjad
• [Wien] How to distinguish the effect of GGA+U and mBJ-GGA in contour plot of electron   Zaid
• [Wien] How to include the external field in wien2k simulations   Yasir Ali
• [Wien] How to include the external field in wien2k simulations   Yasir Ali
• [Wien] How to use LDA+U   Yasir Ali
• [Wien] How to use LDA+U   tran at theochem.tuwien.ac.at
• [Wien] HSE   Yundi Quan
• [Wien] HSE   tran at theochem.tuwien.ac.at
• [Wien] init mbj lapw command not found   Yundi Quan
• [Wien] init mbj lapw command not found   Fabiana Da Pieve
• [Wien] Installation problems in WIEN2k13.1   Krisna Swaroop Sharma
• [Wien] Installation problems in WIEN2k13.1   Peter Blaha
• [Wien] Is FEDORA is preferable to UBUNTU for Wien2k code ? or Which one is more suitable ?   Zaid
• [Wien] Is FEDORA is preferable to UBUNTU for Wien2k code ? or Which one is more suitable ?   Rishi Singh
• [Wien] Is FEDORA is preferable to UBUNTU for Wien2k code ? or Which one is more suitable ?   Laurence Marks
• [Wien] Is FEDORA is preferable to UBUNTU for Wien2k code ? or Which one is more suitable ?   Zaid
• [Wien] Issue on Spin-olarized DOS including spin-orbit coupling   Madhav Ghimire
• [Wien] issues related to mBJ   Fabiana Da Pieve
• [Wien] issues related to mBJ   Peter Blaha
• [Wien] issues related to mBJ   Fabiana Da Pieve
• [Wien] kinetic energy in WIEN2k   Yundi Quan
• [Wien] kinetic energy in WIEN2k   tran at theochem.tuwien.ac.at
• [Wien] kinetic energy in WIEN2k   Yundi Quan
• [Wien] L'approximation MBJ   Sameh noui
• [Wien] L'approximation MBJ   tran at theochem.tuwien.ac.at
• [Wien] L'approximation MBJ   Michael Sluydts
• [Wien] L'approximation MBJ   Jose Alfredo Camargo Martinez
• [Wien] minor error(?) report : confusing behavior in QTL? (symmetrize)   Kim Kyoo
• [Wien] mpiexec_mpt   Luis Ogando
• [Wien] mpiexec_mpt   Laurence Marks
• [Wien] mpiexec_mpt   Oleg Rubel
• [Wien] mpiexec_mpt   Luis Ogando
• [Wien] mpiexec_mpt   Oleg Rubel
• [Wien] mpiexec_mpt   Luis Ogando
• [Wien] mpiexec_mpt   Peter Blaha
• [Wien] mpiexec_mpt   Laurence Marks
• [Wien] Multicore on i7 iMac   pluto at physics.ucdavis.edu
• [Wien] Multicore on i7 iMac   Peter Blaha
• [Wien] Multicore on i7 iMac   pluto at physics.ucdavis.edu
• [Wien] Multicore on i7 iMac   Peter Blaha
• [Wien] occupancy in wien2k   wasim raja Mondal
• [Wien] occupancy in wien2k   Peter Blaha
• [Wien] One problem at a time   Luis Ogando
• [Wien] One problem at a time   Laurence Marks
• [Wien] phonons   Antonio Vanderlei dos Santos - Fisica
• [Wien] phonons   Lyudmila Dobysheva
• [Wien] Plasma frequency in semi-metal case and effect of band folding on optical properties   venkatesh chandragiri
• [Wien] Plasma frequency in semi-metal case and effect of band folding on optical properties   Peter Blaha
• [Wien] Plasma frequency in semi-metal case and effect of band folding on optical properties   venkatesh chandragiri
• [Wien] Plasma frequency in semi-metal case and effect of band folding on optical properties   Peter Blaha
• [Wien] Plasma Freuency Not Obtained   Yasir Ali
• [Wien] Plasma Freuency Not Obtained   Peter Blaha
• [Wien] Plasma Freuency Not Obtained   Yasir Ali
• [Wien] Plasma Freuency Not Obtained   Peter Blaha
• [Wien] Plasma Freuency Not Obtained   Yasir Ali
• [Wien] plot wavefunction   Yundi Quan
• [Wien] Probelm of the enhanced SOC parallel calculation   Chang-Jong Kang
• [Wien] Probelm of the enhanced SOC parallel calculation   Peter Blaha
• [Wien] Probelm of the enhanced SOC parallel calculation   Chang-Jong Kang
• [Wien] qtl fails with symmetrize on for nonmagnetic +SO calc.   Kim Kyoo
• [Wien] real basis projection for f-orbitals   Chang-Jong Kang
• [Wien] real basis projection for f-orbitals   Kim Kyoo
• [Wien] Reg: Error while running "x lapwso -band -dn"   Peram sreenivasa reddy
• [Wien] Reg: Error while running "x lapwso -band -dn"   万博
• [Wien] Reg: wannier function   Swetarekha Ram
• [Wien] Reg: wannier function   Elias Assmann
• [Wien] Regarding Range of DOS   SANJAY KUMAR SINGH
• [Wien] Rkmax   Francisco Garcia
• [Wien] Rkmax   tran at theochem.tuwien.ac.at
• [Wien] run_bandplothf problem crash for HF   Martin Gmitra
• [Wien] runing error: "forrtl: severe (71): integer divide by zero"   贾亚磊
• [Wien] suggestion-qtl, l=2, hexagonal case.   Kim Kyoo
• [Wien] temperature influence on EFGs calculations   abdel Mar..
• [Wien] temperature influence on EFGs calculations   Rocquefelte
• [Wien] temperature influence on EFGs calculations   abdel Mar..
• [Wien] temperature influence on EFGs calculations   Rocquefelte
• [Wien] The coming LAPW1.ERROR   Tuo Cai
• [Wien] three-dimensional charge density   wang yuanxu
• [Wien] User Guide Wien2k 13.1   abdel Mar..
• [Wien] User Guide Wien2k 13.1   Eamon McDermott
• [Wien] WIEN2k and STANDARD bravais matrix of monoclinic   MAHDI SALMANI HIRMAND
• [Wien] WIEN2k and STANDARD bravais matrix of monoclinic   Rostam Golesorkhtabar
• [Wien] wien2k workshop   Peter Blaha
• [Wien] wien2venus.py problem   Yasir Ali
• [Wien] wien2venus.py problem   Dr. Sharat Chandra
• [Wien] Wien2Wannier with spin-orbit coupling   Kyohn Ahn
• [Wien] WIEN2WANNIER: real/compex case   Oleg Rubel
• [Wien] XCPOT = 99 is available?   Chang-Jong Kang
• [Wien] XCPOT = 99 is available?   Peter Blaha
• [Wien] XCPOT = 99 is available?   tran at theochem.tuwien.ac.at
• [Wien] XCPOT = 99 is available?   Chang-Jong Kang
• [Wien] XCPOT = 99 is available?   tran at theochem.tuwien.ac.at
• [Wien] XMCD for Mn   prasenjit roy
• [Wien] XMCD for Mn   Fecher, Gerhard
• [Wien] XMCD for Mn   Peter Blaha

Last message date: Wed Jul 31 19:49:00 CEST 2013
Archived on: Wed Jul 31 19:50:14 CEST 2013

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