November 2002 Archives by author

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Starting: Fri Nov 1 18:59:42 CET 2002
Ending: Fri Nov 29 22:26:55 CET 2002
Messages: 94

[CPMD-list] Questions about MD Salomon Billeter
[CPMD-list] Initial velocities Carina Bäcktorp
[CPMD-list] CPMD-list IFC compilation under SuSE 8.0 Alessandro Contini
[CPMD-list] CPMD-list IFC compilation under SuSE 8.0 Alessandro Contini
[CPMD-list] getting the CPMD code Alessandro Curioni
[CPMD-list] Large-scale DFT calculations? Alessandro Curioni
[CPMD-list] PhD position, Comput. Biochem., CSCS/ETH Zurich (fwd) Dirk Deubel
[CPMD-list] Initial velocities Nikos Doltsinis
[CPMD-list] About NPT Yi Gao
[CPMD-list] pseudopotential files Yi Gao
[CPMD-list] getting the CPMD code Valentin Gogonea
[CPMD-list] Help with molecular crystals Juerg Hutter
[CPMD-list] How to get the CONSTRAINT file? Juerg Hutter
[CPMD-list] Corrupted memory message on IBM-SP3 Juerg Hutter
[CPMD-list] [Fwd: Charge calculation] Juerg Hutter
[CPMD-list] the calculation of H monovalent cation Juerg Hutter
[CPMD-list] LSD Juerg Hutter
[CPMD-list] the basis sets of CPMD Juerg Hutter
[CPMD-list] the difference between isolated molecule and Cell Juerg Hutter
[CPMD-list] QM/MM problem Juerg Hutter
[CPMD-list] Initial velocities Juerg Hutter
[CPMD-list] problem with compiling CPMD Eyvaz Isaev
[CPMD-list] problem with compiling CPMD Eyvaz Isaev
[CPMD-list] Compiling CPMD 3.5.3. using IFC Eyvaz Isaev
[CPMD-list] Re: compilin CPMD (3.5.3) using IFC Eyvaz Isaev
[CPMD-list] CPMD-list IFC compilation under SuSE 8.0 Eyvaz Isaev
[CPMD-list] I couldn't receive the user name and password. Yongjun Jiang
[CPMD-list] MD at fixed tempeature R Jkhurdakar
[CPMD-list] MD at fixed tempeature R Jkhurdakar
[CPMD-list] Charge calculation Julia Khalack
[CPMD-list] [Fwd: Charge calculation] Julia Khalack
[CPMD-list] [Fwd: Charge calculation] Julia Khalack
[CPMD-list] constraints Axel Kohlmeyer
[CPMD-list] constraints revisited Axel Kohlmeyer
[CPMD-list] problem with compiling CPMD Axel Kohlmeyer
[CPMD-list] How to get the CONSTRAINT file? Martin Konopka
[CPMD-list] Corrupted memory message on IBM-SP3 Jung Goo Lee
[CPMD-list] qery on KS energy calculation and eigenvalues MENON, MAHESH
[CPMD-list] Liquid calculation (fwd) Chiranjib Majumder
[CPMD-list] constraints Phineus Markwick
[CPMD-list] constraints revisited Phineus Markwick
[CPMD-list] oxygen and graphite Natasa Mateljevic
[CPMD-list] optimization Natasa Mateljevic
[CPMD-list] LSD Natasa Mateljevic
[CPMD-list] geometry optimization Natasa Mateljevic
[CPMD-list] singlet and triplet Natasa Mateljevic
[CPMD-list] singlet and triplet Natasa Mateljevic
[CPMD-list] which pp choose Pierre Mignon
[CPMD-list] Large-scale DFT calculations? Ichiro Nagano
[CPMD-list] (no subject) Rongjian Sa
[CPMD-list] TM pseudopotential Rongjian Sa
[CPMD-list] how to calculate the H monovalent cation Rongjian Sa
[CPMD-list] compile the cpmd2cube Rongjian Sa
[CPMD-list] the basis sets of CPMD Rongjian Sa
[CPMD-list] how to cpmpile the cpmd2cube Rongjian Sa
[CPMD-list] the difference between isolated molecule and Cell Rongjian Sa
[CPMD-list] the compile of cpmd2cube Rongjian Sa
[CPMD-list] the compile of cpmd2cube Rongjian Sa
[CPMD-list] QM/MM problem Rongjian Sa
[CPMD-list] the movie program Rongjian Sa
[CPMD-list] (no subject) Sergey
[CPMD-list] problem with IFC and MKL Sergey
[CPMD-list] Compiling Using IFC and MKL Sergey
[CPMD-list] MPI jobs hang...for ever. HW Sheng
[CPMD-list] How to set the NOSE ELECTRONS parameters. HW Sheng
[CPMD-list] How to set the NOSE ELECTRONS parameters. HW Sheng
[CPMD-list] How to do unit cell optimization? HW Sheng
[CPMD-list] Large-scale DFT calculations? HW Sheng
[CPMD-list] How to do unit cell optimization? HW Sheng
[CPMD-list] the movie program HW Sheng
[CPMD-list] CPMD-list IFC compilation under SuSE 8.0 Christian Tuma
[CPMD-list] Question about molecular systems in CPMD Christian Tuma
[CPMD-list] Total energy for periodic systems with charged unit cell Christian Tuma
[CPMD-list] the difference between isolated molecule and Cell Christian Tuma
[CPMD-list] lattice parameter optimize Xiong Yuming
[CPMD-list] XC in the pseudopotential file cpmd
[CPMD-list] singlet and triplet cpmd
[CPMD-list] the basis sets of CPMD cpmd-list at cpmd.org
[CPMD-list] MD at fixed tempeature Ari.P.Seitsonen at iki.fi
[CPMD-list] qery on KS energy calculation and eigenvalues Ari.P.Seitsonen at iki.fi
[CPMD-list] MD at fixed tempeature Ari.P.Seitsonen at iki.fi
[CPMD-list] lattice parameter optimize Ari.P.Seitsonen at iki.fi
[CPMD-list] XC in the pseudopotential file Ari.P.Seitsonen at iki.fi
[CPMD-list] problem with compiling CPMD (Yu.Mitrokhin) mit
[CPMD-list] Help with molecular crystals mkosmows
[CPMD-list] How to do unit cell optimization? mkosmows
[CPMD-list] How to do unit cell optimization? mkosmows
[CPMD-list] NiAl ÌÚÓ¢Ôª
[CPMD-list] compile ÐÜÓñÃ÷
[CPMD-list] compile ÐÜÓñÃ÷
[CPMD-list] problem with compiling CPMD C ергей Лисенков
[CPMD-list] Compiling CPMD using IFC and MKL C ергей Лисенков
[CPMD-list] Compiling CPMD 3.5.3. using IFC C ергей Лисенков
[CPMD-list] "grid.x" 市川研究

Last message date: Fri Nov 29 22:26:55 CET 2002
Archived on: Sat Mar 10 00:14:51 CET 2007

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