Index
- Theoretical Chemistry Group Heidelberg
- Miskhail Lemeshko (Austria)
- Laura K. McKemmish (University of New South Wales)
- Ramon Hernandez
- Kaestner, Stuttgart
- Robert van Leeuwen (Jyväskylä, Finland)
- Andrew J. Alexander (Edinburgh, UK)
- Claire Vallance (Oxford, UK)
- Anthony Meijer (Sheffield, UK)
- Max Born Institute (Marc Vrakking)
- Women in theoretical and computational chemistry
- Leo Meerts
- Theoretische chemie Wuppertal
- Stefan Willitsch (Basel, ultracold molecular ions)
- Pavanello @ Rutgers
- Steven Hoekstra (KVI)
- Johannes Neugebauer (Müenster)
- Comutational Physics and Chemistry (UvA)
- Computational Materials Science (UT)
- Computational Biophysics (W. Briels)
- Christoph Meier (Universite Paul Sabatier)
- Theoretical and Computational Chemistry (Xi Chu)
- Warsaw group
- Molecule and Laser Physics (MLF)
- CWI, Stacey Jeffery, Bastiaan Braams
- Atmospheric
photo physics (Wim J. van der Zande, AMOLF).
- Molecular Atmospheric
Processes (MAP).
- Theoretische Chemie Bonn (S. Peyerimhoff)
- Theoretische Chemie München (W. Domcke)
- Theoretical Chemistry Utrecht
-
Theoretical Chemistry Eindhoven (A.P.J. Jansen)
- Free University Amsterdam, Chemistry.
- Theoretical Chemistry Groningen
- Theoretical Chemistry Leiden (Marc van Hemert, Geert-Jan Kroes)
- Leiden Observatory, Department of Astronomy (Ewine van Dishoeck)
-
Jeremy M. Hutson Group (Durham)
- Miller Group (UCBerkeley)
- Saykally Group (UCBerkeley)
- Anthony Stone (Cambridge, UK)
- David Manolopoulos (Oxford, UK)
- Herschel Rabitz (Princeton)
- Balakrishnan (University of Nevada)
- Sean Smith, University of Queensland
- Jonathan Tennyson
(University College London),
European task force laboratory astrophycis
- Don Truhlar Group
(Mineapolis, Minnesota)
- Bochum
- Dan Gezelter (Notre Dame)
- MKMCXX, C++ program for constructing microkinetic models
- vibca.for
- Scientific Computing Department
- PROSPE: Programs for ROtational SPEctroscopy
- Heidelberg MCTDH package
- HIBRIDON (Millard Alexander)
- MOLSCAT (Jeremy Hutson)
- Diatomic Honl-London factor computer program
- Open MM
- Linux4chemistry
- PQS (parallel quantum solutions)
- Wavepacket
- GAP - Groups, Algorithms, Programming
- RKR, Franck-Condon, etc. by
Robert J. Le Roy, University of Waterloo
- quantemol (Electron-molecule)
- Fitting Diatomic spectra (Robert J. Le Roy)
- Computational Chemistry Software
- Computer Physics Communications
(program library)
- DynaSo, time-dependent
dynamics package by Tong Peng, Donghui Zhang, John Zhang.
- gOpenMol
(visualisation program by L.Laaksonen) and
manual by Scott L. Anderson
- Orient (Anthony Stone, Cambridge, UK)
- QCPE
- DAN II meeting (Leiden, November 28, 2018)
- EUCMOS - European congress on molecular spectroscopy
- 16th Interantional Congress of Quantum Chemistry (June 18-23, 2018, Menton, France)
- Cold and Controlled Molecules (Centro Stefano Franscini in Switzerland)
- International Symposium on Free Radicals
- AMO Lunteren
- Sectie Atoom-, Molecuul-, en
Optische fysica, Nederlandse Natuurkundige Vereniging
- ACS meetings
- CECAM Workshops
- Gordon Conferences
-
mathematics and computer science conferences
- Royal Society of Chemistry (RSC) conferences
- Faraday discussions
- Telluride
- International Workshop on Ultrafast
Chemical Physics & Physical Chemistry UCP2011
(14-16 December 2011, University of Strathclyde in Glasgow, UK)
- CHAINS 2011 (28-30 November 2011, Maarssen, Netherlands)
- European Conference on Laboratory Astrophysics (Paris, France, September 26-30)
- Joop (Oudega, Friesland, The Netherlands, September 23-24)
- COMET (Oxford, 11-16 Sept, 2011)
- Negative
ions and molecules in astrophysics
- Quantum Reactive Scattering (New Mexico, July 17-21, 2011)
- WATOC2011(Santiago de Compostela, Spain, July 17-22, 2011)
- Dynamics of Molecular Collisions Conference 2011 (Snowbird, Utah, 10-15 July, 2011)
- DAMOP 2011 (Atlanta, Georgia, June 13-17)
- The Molecular Universe (Toledo, Spain, May 30 - June 3, 2011)
- ICOLS Student Workshop 2011 (May 30 - June 3, Hannover
- Workshop Astrochemistry
- Astrochemistry meeting
(Eindhoven, 5-7 Jan 2011)
- Intermolecular Interactions: New Challenges for ab initio Theory (Telluride, CO, 9-13 aug 2010)
- Damop 2010(Houston, TX, 25-29 May, 2010)
- 17th Canadian Symposium on Theoretical Chemistry
- Tenth International Conference on Computational Scienc (Amsterdam, May 31 - June 2, 2010)
- Spectroscopy & Theory, Crystallography & Structural Research, Macromolecules, Chemistry of the Solid State & Materials Science, and Liquids & Interfaces (Veldhoven, 15+16 Feb 2010)
- 5-11 sept 2009, BEC2009 Sant Feliu, Spain
- Faraday discussion 142: cold and ultracold molecules
- March 19-23, 2007, DPG conference Duesseldorf
- August 12-17, 2007, 29th International Free Radicals Symposium Big Sky, Montana
- March 19-23, 2007, Spring meeting of the German Physical Society DPG, Duesseldorf, Germany
- November 10-14, 2006, Stereodynamics 2006, Arcachon, France
- October 29 - November 2, 2006, Wilhelm und Else Heraeus Seminar on Cold Molecules, Bad Honnef, Germany
- September 11-15, 2006, MOLEC 2006, Levico Terme (Trento), Italy
- March 5-10, 2006, Achievements and Perspectives of Cold Molecules, Les Houches, France
- October 19-22, 2005,
Workshop on Cold Polar Molecules, Ringberg Castle, Bavaria, Germany
- October 16-20, 2005,
Ultracold
collisions symposium at Laser Science XXI, Tucson, AZ
- July 24-27, 2005, CCP6 Workshop on Vector Correlation and Alignment in Chemistry, Bristol, UK
- July 3-8, 2005, Theory of Ultracold Molecules, Telluride (Colorado), USA
- January 23-26, 2005, International Karlsruhe Nanoscience Workshop, Karlsruhe
- January 9-14, 2005, Gordon Research Conference On Molecular Energy Transfer (GRCOMET)
- November 28 - December 3, 2004, International Symposium on Stereodynamics of Chemical Reactions, Osaka, Japan
- September 5-10, 2004, Molec XV, Nunspeet, The Netherlands
- September 2-5, 2004,
Quantum Dynamics at Conical Intersections, Nunspeet, The Netherlands
- August 7-12, 2004, 18th international Symposium on Gas Kinetics
- 11-16 July 2004,
GRC on Atomic and Molecular Interactions,
program
- 6-10 July 2004, ECAMP VIII
European Conference on Atomic and Molecular Physics, PAMO 2004
- March 30 - April 3, 2004,
Bose-Einstein Condensation: from atoms to molecules, Durham, UK
- February 15-20, 2004, Theory and applications of computational chemistry, Gyeongju, Korea
- January 8-10, 2004, Ultracold
Polar Molecules: Formation and Collisions
- 18-21 Septermber 2003,A Coastal Voyage in Quantum Chemistry, Tromso-Trondheim, Norway
- 8-12 September 2003,HRMS 18th coll on High Resolution
Molecular Spectroscopy, Dijon, France
- July 13-18, 2003, Dynamics
of Molecular Collisions, Lake Tahoe
- June 16-20, 2003, 58th
international symposium on molecular spectroscopy, OHIO State
- June 15-20, 2003,
COMET XVIII International
Conference on Molecular Energy Transfer, San Lorenzo de El Escorial, SPAIN
- June 20-23, 2003, The VII Workshop on Quantum Reactive Scattering,
San Lorenzo de El Escorial, SPAIN
- June 8-13, 2003, XX Symposium on Molecular Beams,
Lisboa, Portugal
- March 31-April 2, 2003, CCP1/CCP6/ChemReact workshop
- MolSim-2018 (January 8-19, 2018, NL)
- 2018 Joint ICTP-IAEA School and Workshop on Fundamental Methods for Atomic, Molecular and Materials Properties in Plasma Environments (other link)
- Molim training school (Belgrade, 2017)
- Cold atoms, Les Houches (France, 2-13 Oct 2017)
- Virtual Winterschool on computational chemistry
- ASTROCHEMISTRY: FROM SPACE TO EARTH (Grenoble, 29-aug-2016)
- Path Integral Quantum Mechanics (Jun 13-17, 2016, Lausanne, Switzerland)
- Practical Course in Biomolecular Modelling, ACMM
- MSSC2014 - Ab initio Modelling in Solid State Chemistry (London, UK, Sep 15-19, 2014)
- Summer School on Experimental Methodology in Computational Science Research (St Andrews, Scotland, UK, 4-8 Aug 2014)
- Summer School on Molecular Materials (Aug 25-29, 2014, Wuerzburg)
- National Training School in Theoretical Chemistry (Oxford, UK)
- Sostrup Summer School
- 191st Summer Course of the International School of Physics "Enrico Fermi" (Varena, Italy, 7-14 July 2014),
- Ultracold Atoms and Precision Measurements (Les Houches, Sept 15-26, 2014)
- Small-Molecule Spectroscopy and Dynamics (Robert Field, MITopenCOURSEware)
- Psi-k Summer School on Ab Initio Molecular Dynamics for Biomolecules (Santo Stefano di Sessanio, Italy, 9-14 June 2013)
- Rome School on Open Systems and the Quantum-Classical Boundary (April 9-12, 2013, Rome)
- European Summerschool in Quantum Chemistry 2013
- Dead Sea winter school, Excitons
- MolSim 2013 (ACMM, UvA, Jan 7-18, 2013)
- Path-Integral Molecular Dynamics (Toulouse, France, June 4-8, 2012)
- Chemistry and Infrared Spectroscopy of Interstellar Dust (Cuijk, the Netherlands, June 4-8, 2012)
- Nordic-NASA Summer school "Water, ice, and the Origi of Life
in the Universe", 2-15 July 2012
- Nanosummerschool (Jacobs University, July 2011)
- International Max-Planck Research School for Ultrafast
Imaging and Structural Dynamics (Hamburg)
- European Summerschool in Quantum Chemistry 2011 (Palermo, Sicily, Italy, Sep. 18 - Oct. 1, 2011)
- Summer school on storage devices and ion traps
- European Summer School Energy and Materials from the Sun
- 5th International Intensive course on Theoretical Chemistry and Computational Modelling (TCCM)
- IMM summer schools
- ICONIC
- Shell effects in finite quantum systems
- (bio)molecular dynamics (Finland)
- Modeling Molecules and Nansystems (MoMoNano)
- European master in Theoretical Chemistry and Computational Modelling
- HRSMC - Holland Research School of Molecular Chemistry
- Ultracold Quantum Gases of Atoms and Molecules,
(Les Houches, 27 sept - 9 oct 2009)
- Han-sur-Lesse, theoretical chemistry
and spectroscopy
- Summer School on Direct Quantum Simulation of Condensed Matter Physics with cold atoms and molecules
- Winter school on theoretical chemistry
(2006)
(Helsinki, Finland)
- Tulip Graduate School
(Noordwijk, Netherlands)
- June 23-28, 2003,
second european school on computational chemistry, reaction and molecular dynamics
(University of Barcelona, Spain)
- August 15-25, 2001,
Summer School in the Quantum Dynamics of Molecular Systems,
University College, Oxford, UK
- C&CZ
- Video chat, zoom, webex, etc
- Peage,
budget
- Printers en printen
- IPSec based vpn
- EduVPN (VPN
- SLURM batch queues
- Batch job: "#SBATCH –gres=heavyio:1
- squeue -a
- News
- dhz.science.ru.nl (set spam filter, password, antivirus settings etc.)
- Printen posters
- Intel compilers, ifort, MKL, iMPI,
select compiler flags
- squirrel
van de B-faculteiten
- Cluster nodes load
- VPN,
ssh -D port user@host, Socks proxy,
- Telefonie
- MathJax, Demo: Copy and paste equations, TeX, Wikipedia, word
- MKL makefile
- MVPS
- Xsede
- Fortran-77 standard
- Rosettacode - algorithms in many languages
- Pathscale compilers open source
- opensuse software, rpms
- www.gigaserver.nl
- High performance computing travel grants
- Convert BibTex to EndNote
- Logon with putty
- F-secure SSH
- www.GeoBytes.com (location of IP address)
- Search engines:
www.kartoo.com,
Google,
www.zoek.nl,
Yahoo,
www.whowhere.com(search e-mail address).
- Benchmarks:
www.SpecBench.org
Performance Database Web site
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Last updated: Oct 18, 2020, by Gerrit Groenenboom,
e-mail: gerritg@theochem.ru.nl.
