| January 31, 2012 |
ADF2012 released |
| January 30, 2012 |
SCM at ACS Spring San Diego, March 25-27 |
| December 15, 2011 |
Christmas break 2011 |
| December 12, 2011 |
J.S. Seldenthuis PhD thesis |
| October 19, 2011 |
SCM at Fall MRS meeting in Boston |
| October 19, 2011 |
SCM at NPS11 meeting in Arnhem |
| October 5, 2011 |
ADF workshop before Quitel |
| September 6, 2011 |
Summer SCM Newsletter Available |
| August 26, 2011 |
ADF at DFT2011 Conference, August 29 - September 2 in Athens, Greece |
| August 16, 2011 |
N3 dye for Dye-Sensitized Solar Cells (DSSCs) modeled |
| August 9, 2011 |
NMR of a Lead - Platinum superatom |
| July 14, 2011 |
ADF at WATOC conference, July 17-22, Santiago de Compostela, Spain |
| June 23, 2011 |
Presentations at Northwestern University, The University of Michigan and Carnegie Mellon University |
| June 16, 2011 |
Publication: Modeling the hydrogen bonds, pi-stacking and solvent effects in DNA |
| May 16, 2011 |
ADF lecture at University College Dublin |
| May 4, 2011 |
Virtual Workshop with Austrialian NCI NF |
| April 28, 2011 |
Spring SCM Newsletter Available |
| April 12, 2011 |
New release of DGrid |
| March 24, 2011 |
SCM Workshop at San Diego Supercomputer Center |
| March 17, 2011 |
Publication: Quantitative AFM with CO-terminated tips |
| February 28, 2011 |
Publication: Relativistic effects up the voltage in batteries |
| February 17, 2011 |
ADF at APS and ACS meetings in March 2011 |
| February 8, 2011 |
SCM Workshops in England: 14-16 February 2011 |
| January 7, 2011 |
All-Electric Single-Molecule Motor modeled with ADF |
| December 9, 2010 |
ADF2010.02 released: ReaxFF and MOPAC2009 |
| December 1, 2010 |
ADF at Pacifichem 2010 |
| November 9, 2010 |
ADF workshop with SARA follow-up |
| October 12, 2010 |
QUASINANO project started |
| October 1, 2010 |
Dr. Stefano Borini joins SCM |
| September 29, 2010 |
ADF2010 released |
| September 28, 2010 |
ADF workshop Beijing |
| September 23, 2010 |
ADF workshop with SARA |
| September 15, 2010 |
ADF2010 seminar in Tokyo |
| August 3, 2010 |
ADF at ACS meeting in August 2010 |
| July 29, 2010 |
ADF-GUI tutorial videos |
| June 1, 2010 |
ADIIS implemented in ADF |
| May 26, 2010 |
Grimme's DFT-D3 Functionals in ADF and BAND |
| May 18, 2010 |
BAND Speed-up |
| May 12, 2010 |
CRS-GUI tutorial videos |
| March 10, 2010 |
BAND-GUI tutorial videos |
| February 5, 2010 |
SCM Demo videos |
| January 22, 2010 |
ADF at APS and ACS meetings in March 2010 |
| December 22, 2009 |
ADF2009.01b released |
| December 18, 2009 |
Case study on OLED modeling with ADF |
| December 14, 2009 |
Vidi grant awarded to Johannes Neugebauer |
| December 3, 2009 |
Publication: Lithium - Ammonia solution modeled at the molecular level |
| November 27, 2009 |
2010 Schrödinger Medal awarded to E.J. Baerends |
| September 30, 2009 |
ADF2009 released |
| August 24, 2009 |
Dr. Marcel Swart appointed ICREA Research Professor |
| August 19, 2009 |
SCM at DFT2009, 31 August - 4 September |
| August 6, 2009 |
Special Issue of Can. J. Chem.: Tom Ziegler |
| July 2, 2009 |
ADF 2009 Preview |
| June 11, 2009 |
Publication: Modeling Ditopic ion-pair receptors with ADF and QUILD |
| June 8, 2009 |
SCM at ICQC, 22-27 June |
| May 15, 2009 |
Publication: Modeling the 32 Electron Rule for Heavy Element Compounds |
| April 21, 2009 |
SCM at NOTUR2009, 18 May |
| April 20, 2009 |
Publication: A 120 atom tetrahedral silver cluster modeled with ADF |
| March 3, 2009 |
Publication: The First Dodecavalent Molybdenum Complex studied with ADF |
| February 12, 2009 |
SCM at ACS Spring meeting Salt Lake City, 22-28 March |
| February 12, 2009 |
Dr. Kundrat joins SCM |
| February 9, 2009 |
ADF overview in Japanese |
| February 9, 2009 |
Restyled SCM web site |
| December 22, 2008 |
Christmas break at SCM |
| November 24, 2008 |
Contributed software: PyFrag - Streamlining your reaction path analysis |
| November 4, 2008 |
Ph.D. thesis Patrícia Bento: Nucleophilic Substitution Reactions
|
| October 10, 2008 |
ADF2008 presentation at Fujitsu seminar Cambridge (UK) October 30
|
| September 22, 2008 |
ADF2008 released |
| September 11, 2008 |
ADF at Fujitsu seminar Tokyo October 2nd |
| September 11, 2008 |
Ryoka ADF2008 seminar Tokyo September 30th |
| September 9, 2008 |
ADF2008 seminar Shanghai evening before TACC |
| September 4, 2008 |
Future continuity SCM arranged |
| August 8, 2008 |
ADF2008: ultrafast Bader AIM implementation |
| July 17, 2008 |
ADF2008 workshop in Sydney, September 13, before WATOC |
| July 14, 2008 |
Publication: Slaters beat Gaussians for Fe-complexes |
| June 18, 2008 |
COSMO-RS module in ADF2007 released |
| June 4, 2008 |
Free utilities to read/write KF-files |
| June 4, 2008 |
ADF development snapshots released |
| June 2, 2008 |
Ph.D. thesis Simon Pierrefixe: Hypervalence and Aromaticity |
| May 27, 2008 |
Ph.D. thesis Manuel Louwerse: Computational Modeling of Oxidation Catalysis |
| April 24, 2008 |
Holiday break SCM, 30 April - 5 May |
| April 18, 2008 |
Dr. Pelmenschikov joins SCM's scientific staff |
| March 26, 2008 |
ADF workshop at CINECA, Bologna, April 16
|
| March 17, 2008 |
ADF at ACS meeting, New Orleans, April 6-10
|
| January 8, 2008 |
ADF workshop in Barcelona, February 25-26
|
| December 20, 2007 |
Ph.D. thesis Dr. Jacob on frozen-density embedding
|
| December 18, 2007 |
Christmas break SCM
|
| September 18, 2007 |
Job opening for computational chemist as Technical Writer / Scientific Support staff member
|
| August 21, 2007 |
ADF2007 released
|
| June 4, 2007 |
ADF at DFT2007 in Amsterdam
|
| May 25, 2007 |
ADF workshop in London
|
| April 27, 2007 |
Ph.D. thesis Dr. de Jong on catalytic bond activation
|
| February 23, 2007 |
Improved interface SNF (vibrational spectra) to ADF
|
| February 5, 2007 |
ADF at DPG meeting Germany
|
| December 20, 2006 |
Christmas break
|
| December 18, 2006 |
ADF Performance on PQS QuantumCube
|
| December 18, 2006 |
ADF2006 for Cray XD1 and IBM LoP
|
| December 18, 2006 |
HP-MPI Supported in ADF2006
|
| December 14, 2006 |
ADF at DFT2007 in Amsterdam
|
| December 1, 2006 |
HP white paper: parallel ADF performance on HP clusters
|
| November 7, 2006 |
BAND optimization projects
|
| November 6, 2006 |
ADF on Intel Mac
|
| October 31, 2006 |
New ADF brochure
available
|
| October 17, 2006 |
Ph.D. theses
on TDDFT for periodic systems and on solvated actinides
|
| October 2, 2006 |
ADF workshop Dortmund, October 10
|
| September 20, 2006 |
Bug fix version ADF2006.01b released
|
| Aug. 22, 2006 |
USA tour for ADF: ACS meeting, Stanford, Northwestern, ...
|
| July 4, 2006 |
ADF2006 released
|
| May 31, 2006 |
ADF2006 preview in Japan and Korea
|
| March 1, 2006 |
SCM forums
introduced for user discussions
|
| February 28, 2006 |
Dr. Philipsen joins SCM for BAND development
|
| February 28, 2006 |
ADF reviewed in JACS and Nachrichten aus Chemie
|
| February 28, 2006 |
ADF at ACS Spring meeting Atlanta, 26-30 March
|
| January 18, 2006 |
Prof. Baerends and Ziegler among most-cited chemists
|
| January 18, 2006 |
WATOC's Dirac medal to Dr. Visscher
|
| January 18, 2006 |
Prestigious VICI grant to Dr. Visscher
|
| December 22, 2005 |
ADF Newsletter
December 2005 available
|
| December 20, 2005 |
Christmas break
|
| October 18, 2005 |
ADF at Pacifichem conference
|
| October 17, 2005 |
Bug fix version ADF2005.01b released
|
| August 26, 2005 |
ADF2005 released!
|
| August 19, 2005 |
ADF2005
seminar in Philadelphia on Friday September 2nd
|
| July 28, 2005 |
ADF2005 workshop
at ACS meeting in Washington
|
| July 28, 2005 |
ADF2005 conference tour:
Washington, Geneva, Guilin, Honolulu
|
| July 28, 2005 |
NMR bug found in ADF2004
|
| April 4, 2005 |
NMR workshop at EUROMAR
Veldhoven, the Netherlands, 3-8 July, 2005.
|
| April 4, 2005 |
Ph.D. thesis Meta van Faassen on Time-dependent current DFT
|
| March 2, 2005 |
Tungsten NMR spin-spin couplings
|
| February 16, 2005 |
New release ADF-GUI modules
|
| February 15, 2005 |
Why cooked lobsters turn red
|
| February 11, 2005 |
ADF at ACS Spring meeting
San Diego, 13-17 March, 2005.
|
| February 2, 2005 |
ADF Newsletter
February 2005 available
|
| Jan. 26, 2005 |
ADF supports find nitrogen-centered
radical compound
|
| Jan. 11, 2005 |
ADF at WATOC conference
|
| Dec. 20, 2004 |
Christmas break SCM
starts Dec. 24th.
|
| Nov. 2, 2004 |
Improved ADF2004.01 for Mac OS X
|
| Sept. 27, 2004 |
Very fast Intel Nocona and AMD Opteron
versions ready!
|
| Sept. 27, 2004 |
Fujitsu PrimePower
supported for ADF2004.01
|
| Sept. 23, 2004 |
ADFview and ADFmovie 2004.02 beta version available
|
| July 6, 2004 |
SUN version ADF2004 available
|
| July 2, 2004 |
ADF Newsletter
June 2004 available
|
| June 17, 2004 |
ADF2004.01 update
|
| May 24, 2004 |
ADF2004.01 released!
|
| May 17, 2004 |
Prof. Baerends member of Academy of Science
|
| Mar. 26, 2004 |
ADF Newsletter March 2004 available
|
| Mar. 10, 2004 |
Ph.D. thesis Dr. Jensen on optical properties of nanostructures
|
| Mar. 8, 2004 |
ADF seminars in California, March-April 2004
|
| Mar. 8, 2004 |
ADF at ACS meeting Anaheim, CA, March 2004
|
| Mar. 8, 2004 |
ADF2003 available on Fujitsu PrimePower
|
| Dec. 23, 2003 |
Emergency ADF license file available during Christmas & New Year break
|
| Dec. 20, 2003 |
Christmas & New Year break at SCM from Dec. 24th - Jan. 4th
|
| Dec. 18, 2003 |
Job opening for Scientific Software Developer
|
| Nov. 7, 2003 |
Ph.D. thesis M. Grüning on improved xc functionals
available
|
| Sept. 4, 2003 |
ADF2003.01 now available on SGI Altix (Itanium2 with Linux)
|
| Aug. 29, 2003 |
ADF at DFT2003 conference in Brussels, 7-12 Sept., 2003
|
| Aug. 29, 2003 |
ADF at national ACS meeting in New York, 8-10 Sept., 2003
|
| Aug. 29, 2003 |
ADF2003.01 now available on HP AlphaServerSC with MPI
|
| Aug. 18, 2003 |
Sad news about Prof. Dr. J.G. Snijders
|
| July 2, 2003 |
ADF paper: Optimized Slater-type basis sets for the elements 1-118
|
| Mar. 25, 2003 |
ADFinput2003.01a version released: bug fixes for ADFinput (only)
|
| Mar. 19, 2003 |
ADF2003.01 version released: GUI and HP Itanium2 support
|
| Mar. 5, 2003 |
Download the SCM Newsletter of March 2003
|
| Mar. 5, 2003 |
ADF lecture series in Japan, May 26-30, 2003
|
| Mar. 5, 2003 |
ADF at national ACS meeting New Orleans, March 24-26, 2003
|
| Mar. 5, 2003 |
ADF Science papers: Actinide-Noble Gas Complexes and Au20
|
| Feb. 14, 2003 |
ADF at Sanibel Symposium 2003
|
| Jan. 2, 2003 |
PDF documentation for ADF2002.03 available
|
| Dec. 20, 2002 |
ADF2002.03 version released
|
| Dec. 18, 2002 |
Analytic second derivatives and NMR optimization project.
|
| Dec. 18, 2002 |
Christmas break and license files.
|
| Dec. 17, 2002 |
Conference announcement: Quantum Inorganic Chemistry, York, UK (April 2003)
|
| Nov. 14, 2002 |
ADF without I/O: SCM advice on ADF performance improvement
|
| Sept. 17, 2002 |
DGrid and Basin programs contributed
These density analysis programs read ADF result files and are
freely available from Dr. Kohout.
|
| Sept. 10, 2002 |
Congratulations to Marcel Swart
on his Ph.D. thesis "Density Functional Theory Applied to Copper Proteins"
|
| August 6, 2002 |
pdb2adf utility available (generate QMMM input from a PDF file) |
| August 6, 2002 |
ADF2002.02: for Sun Solaris |
| August 6, 2002 |
ADF2002.02: add PVM version for SGI IRIX64 6.5
(so MPI, PVM and serial versions available) |
| July 24, 2002 |
ADF2002.02 for Windows (98, NT, 2000) |
| July 17, 2002 |
ADF2002.02 for Macintosh OS X |
| July 10, 2002 |
ADF2002.02
version available, including ADFview visualization tool and simplified densf utility |
| August 4-9, 2002 |
Meet us at the WATOC '02 conference in Lugano, Switzerland |
| June 6, 2002 |
ADF 2002.01 IBM MPI version available |
| May 8, 2002 |
ADF 2002.01 Macintosh OS X version available |
| April 23, 2002 |
Full color brochure on ADF, BAND and ADF-GUI |
| April 19, 2002 |
ADF User's Guide updated: now all index entries available as bookmarks |
| April 18, 2002 |
ADF 2002.01 Sun version available |
| April 3, 2002 |
ADF User's Guide updated: Bookmarks included |
| April 1, 2002 |
Dr. Erik van Lenthe joins SCM team |
| April 2002 |
Meet us at the Spring ACS expo in Orlando |
| March 2002 |
Start of SCM news archive |
