ADF-LIST Archive
2000 by author

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AuthorSubject Date
Alexei Yakovlev
 Error calculating NH3 frequencies2000-01-26 16:22:11
Angel Magnanes Perez
 Parallel ADF2000-07-11 10:55:19
Antonio Aramburu
 PhD studentship2000-01-27 20:10:20
boris le guennic
 NMR Calculation with Zora Basis2000-11-28 10:26:41
Carles Bo Jane
 New ADF utilities and Bader's charge density analysis software2000-11-29 18:50:43
 Re: Freq visualisation?2000-11-10 13:07:21
 Re: Freq visualisation?2000-11-10 14:32:48
Christian Stadler
 Re: Level shift of ADF2.3 and ADF20002000-06-30 10:01:50
Dave Price
 Lanthanide calculations2000-05-20 15:09:05
 Problem compiling ADFrom99 on SGI2000-11-13 12:26:31
 Freq visualisation?2000-11-10 12:01:35
 Re: Reply Zora2000-09-20 13:09:54
 Summary: visulisation programs for ADF19992000-01-31 12:30:57
 Visualisation of ADF1999 results2000-01-18 15:54:00
DM Sherman
 Re: COSMO2000-06-06 14:27:17
Dr R J Deeth
 Re: ADF performance on a Pentium III PC2000-12-14 12:33:51
 Post doc in Inorganic Computational Chemistry2000-10-16 13:07:30
 Warwick Univ: 1/2 day symposium on Comp. Chem. for TM systems2000-02-17 15:25:35
Dr. Reinaldo Pis Diez
 Dissociation curves in Adf2000-07-11 20:06:56
Dr. T. Raaska
 Third call : Minisymposium on DFT methods ( ADF )2000-08-02 12:17:17
 First call: Minisymposium on DFT methods ( ADF )2000-04-20 08:26:22
Erik van Lenthe
 Re: g-tensor output format2000-02-17 12:19:30
Ewald Pauwels
 Electron smearing2000-09-26 13:50:09
 CIO_ERROR2000-09-20 15:17:58
F. Lelj Garolla di Bard
 basis and fit set2000-12-04 12:06:55
fan
 Date: Tue, 12 Dec 2000 12:50:10 +01002000-12-13 14:40:04
Francesco Lelj Garolla
 R: Visualisation of ADF1999 results2000-01-19 14:26:57
Frank Glahe AC-III C2-05-329 Tel.3747
 Summary: Protonation energies2000-06-23 14:04:59
 RE: Protonation energies2000-06-20 13:08:26
 Protonation energies2000-06-19 09:33:06
G. Matthias Ullmann
 COSMO2000-06-02 23:16:11
gracia
 Reply Zora2000-09-20 10:53:12
 Zora2000-09-19 17:02:26
Gunnar Jeschke
 Re: ADF performance on a Pentium III PC2000-12-12 12:57:13
Hege Ryeng
 Excitation calculation2000-08-17 10:47:05
John McGrady
 EPSRC-funded postdoc in computational chemistry2000-05-25 17:19:21
Jun Li
 Re: Lanthanide calculations2000-12-07 20:08:19
Karine COSTUAS
 (no subject)2000-09-28 16:02:13
Lou Noodleman
 Re: Protonation energies2000-06-21 19:54:07
 Re: Protonation energies2000-06-21 19:53:29
Louwen, J. (Jaap)
 ADF performance on a Pentium III PC2000-12-11 16:36:28
Maija Lahtela
 a course how to use ADF ?2000-03-02 09:16:52
Marcel Swart
 Re: Excitation calculation2000-08-17 11:20:11
 Re: Protonation energies2000-06-20 12:52:06
 Re: COSMO2000-06-06 14:58:20
Meike Reinhold
 redirection of TAPE* files2000-12-05 19:17:45
 Pt basis set with polarisation functions2000-10-06 16:11:07
Nik Kaltsoyannis
 EPSRC PhD studentship available2000-01-27 18:27:08
Ole.Swang_at_email.domain.hidden
 Frequencies after deuteration2000-01-18 15:24:10
Pat Carl
 g-tensor output format2000-02-16 21:51:34
Peter Howe
 Re: Summary: visulisation programs for ADF19992000-01-31 15:01:09
Philip Coppens
 logfile2000-04-04 22:43:24
Pierre Kennepohl
 manipulating TAPE41 files2000-04-30 00:17:55
 SDF_ADF problem...2000-01-31 02:53:18
Robert Stranger
 PhD Scholarship2000-12-13 07:55:10
 Postdoc position in computational chemistry2000-04-10 09:14:30
 Postdoctoral Position in Computational Chemistry2000-03-06 04:40:21
Rodion V. Belosludov
 PostDoc position2000-01-24 13:22:53
 (no subject)2000-01-24 09:27:58
Serguei Patchkovskii
 Re:2000-09-28 17:16:15
 Re: Parallel ADF2000-07-11 18:12:50
 Re: Protonation energies2000-06-20 17:34:01
sidoumou mohamed
 Re: CRYSTAL2000-03-08 10:35:13
 CRYSTAL2000-02-12 14:40:01
Stan van Gisbergen
 Re: ADF performance on a Pentium III PC2000-12-12 13:56:10
 cio errors in ADF2000-09-28 17:25:46
Stanislas Remy
 ADF-Band question2000-05-17 17:43:36
Stuart Macgregor
 ADF Error2000-11-10 01:21:42
 Re: Freq visualisation?2000-11-10 01:13:41
Tom Woo
 Bond orders with ADF?2000-11-06 15:59:45
Tomoo Nukada
 Posdoc, quantum chemistry, reaction mechanisums, Canada/Japan2000-03-01 05:52:25
uddin_at_email.domain.hidden
 libpvm [xxxxx]: pvmbeatask() pvmd didn't validate itself2000-12-12 18:57:56
Ulrich Senn
 pvm 3.3.11 + loadleveler on IBM/SP22000-12-06 09:05:37
 adf-2000.02 + pvm 3.3.11 + loadleveler on IBM/SP22000-12-05 11:27:35
Valentina Vetere
 hirshfield charges2000-12-13 11:14:20
Vicenç Branchadell
 PhD studentship available2000-01-26 17:44:43
Wenge Han
 QM/MM hybrid potential2000-08-22 01:33:57
 Level shift of ADF2.3 and ADF20002000-06-29 23:29:51
xhwan
 (no subject)2000-10-31 08:41:31
 (no subject)2000-10-11 03:51:26
 (no subject)2000-07-07 07:29:17
 for help2000-04-10 03:17:56
 for Theory used in ADF2000-03-24 07:45:09
ziegler_at_email.domain.hidden
 PDF Position2000-04-11 19:40:26

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