The Amsterdam Density Functional Program (ADF) has a long history. Its development has. Been started at a time (the early seventies) when the full potential and implications of density. Amsterdam Density Functional (ADF) is a program for first-principles electronic structure calculations that makes use of density functional theory (DFT). ADF was first developed in the early seventies by the group of E. Baerends from the Vrije Universiteit in Amsterdam, and by the group of T. Ziegler from the University of Calgary. All calculations were carried out using the Amsterdam Density Functional (ADF) 2017.103 program.11 The equilibrium geometries and energies of pnictogen-bonded complexes were computed at the DFT level using the meta-hybrid functional M06.12 A large uncontracted relativistically optimized QZ4P. Our density functional program ADF (Amsterdam Density Functional) has the X-alpha parametrization as one of the density functional options. ADF is commercially licensed. For academic institutions we ask a one-time fee of 1500 Dutch Guilders (approx. US$ 850) and (optionally) 500 Dutch Guilders per year for regular updates.
Amsterdam Density Functional (ADF) Program
ADF has a 30-year track record as a premium-quality quantum chemistry software package based on Density Functional Theory (DFT).Main features:- the molecular DFT program ADF- the periodic DFT program BAND- the post-ADF COSMO-RS program for thermodynamics of liquids- The ReaxFF program for modeling chemical reactions
- Publisher: Scientific Computing & Modeling
- Home page:www.scm.com
- Last updated: April 29th, 2013
Youda Legend: The Curse of the Amsterdam Diamond
The curse of the Amsterdam diamond is a hidden object adventure. An eagles eye and common sense will lead you through the adventure in the nice city of Amsterdam. Clues and tools that are hidden will give you plenty of reasons to hold on to and the great design will make your heart beat just a little faster.
- Publisher: Youda Games
- Last updated: July 6th, 2010
AutoAFCADUpdaterX for Mega Airport Amsterdam X
AutoAFCADUpdaterX (for Mega Airport Amsterdam X) can be used to automatically update the wind direction on the corrected AFCAD-files by 737freak (from A51-Zone.net - the game community). It is very easy to use. Just click the shortcut and it will update the the AFCADS with the correct wind direction.
- Publisher: A51-Zone
- Last updated: January 12th, 2011
GAMESS for Microsoft Windows 32-Bit
GAMESS is a General Atomic and Molecular Electronic Structure System written and maintaned by the Gordon research group a Iowa State University.GAMESS is a program for ab initio molecular quantum chemistry.Calculates RHF, UHF, ROHF, GVB, or MCSCF selfconsistent field molecular wavefunctions.
- Publisher: Iowa State University
- Home page:www.msg.chem.iastate.edu
- Last updated: October 13th, 2011
Rainy Screensaver
Screensaver featuring realistic rain drops, lightnings and thunderclaps whit fully customizable settings. You can adjust the density and radius of the rain drops, the volume of the thunderclaps, and the color and delay between lightnings, among other values. The evaluation version runs fully during 15 days; after that time, you must purchase the full version.
- Publisher: Elastis Systems
- Home page:www.elasticsystems.com
- Last updated: November 17th, 2009
Join (Merge, Combine) Multiple Rar Files Into One Software
Join (Merge, Combine) Multiple RAR Files Into One helps you to keep your RAR library organized. It allows you to create a new RAR file by putting together the files contained in any number of existing RAR archives. Its simple yet effective interface allows you to select the input files to merge either one by one or by loading all the RAR files contained in a folder and its subfolders.
- Publisher: Sobolsoft
- Last updated: December 27th, 2008
RAR to ZIP Converter
Being a native format of the WinRAR archiver, RAR files may be hard to handle if you don’t happen to have the right program for the task. RAR to ZIP Converter allows you to transform “inaccessible” RAR files into the more accessible ZIP file, widely used and recognized by most archive-related tools. This free tool is (probably) the simplest way of converting RAR archives into compressed ZIP files.
- Publisher: rartozipconverter.com
- Home page:www.rartozipconverter.com
- Last updated: January 19th, 2014
Free RAR Extract Frog
Free RAR Extract Frog takes easy RAR extraction and decompression to the next level. It does not matter if the RAR file is a standard one, a multipart RAR file, or a password-protected RAR archive – simply drag it and drop it onto the program’s customizable interface, and it’ll be decompressed for you in a breeze.
- Publisher: Philipp Winterberg
- Last updated: December 3rd, 2015
Spartan '16
The latest Spartan'16 release continues collaboration with Q-Chem, and provides a full range of computational models, spanning Molecular Mechanics, Semi-Empirical models, Hartree-Fock Molecular Orbital models, post-Hartree-Fock models including Density Functional and Moller Plesset approaches, as well as Thermochemistry recipes.
- Publisher: Wavefunction, INC
- Home page:www.wavefun.com
- Last updated: November 16th, 2017
Dacapo
Dacapo is a total energy program based on density functional theory. It uses a plane wave basis for the valence electronic states and describes the core-electron interactions with Vanderbilt ultrasoft pseudo-potentials. For an overview see the Pseudopotential_Library page.Calculations using dacapo are done using the Atomic Simulation Environment (ASE).
- Publisher: FEV Motorentechnik GmbH
- Home page:wiki.fysik.dtu.dk
- Last updated: October 14th, 2011
RAR Password Unlocker
RAR Password Unlocker allows you to quickly recover forgotten or lost passwords for RAR archives created by WinRAR and other tools. It allows you to recover RAR passwords faster than other tools using GPU acceleration, Multi-core CPU, SSE and more.
- Publisher: PasswordUnlocker
- Last updated: July 2nd, 2020
RAR Password Recovery
In case that you forgot the password for your RAR files, what should you do? Well, take it easy, AnyPasskey RAR Password Recovery could help you reset or remove RAR password for your convenient enjoyment.
- Publisher: Intelore
- Home page:www.in-mediakg.de
- Last updated: July 27th, 2012
RAR Password Recovery Magic
Got a Password Protected RAR Archive? Forgot the password? Then RAR Password Recovery Magic is for you! Just load the password protected RAR file and press the start button. Then the program will systematically search for possible passwords, until the required one is found.
Amsterdam Density Functional Adf Program
- Publisher: Password Recovery Magic Studio Ltd.
- Last updated: February 3rd, 2009
Dziobas Rar Player
Dziobas Rar PLayer is a simple and handy video player where you will be able to play any video and DVD on your PC. But maybe the main interesting feature of this free video player, is that if you are downloading a rar file that contains a video, you will be able to watch it without the need of downloading the complete file.
- Publisher: Kamil Dzióbek
- Home page:www.grupyorto.appspot.com
- Last updated: December 9th, 2010
RAR Recovery Toolbox
Repairs affected RAR archives, restores affected checksums, opens damaged files that were corrupted during their download or by any other reason. The utility is as easy as the original file compression tool, users may easily open rar archives.
- Publisher: Recovery Toolbox, Inc.
- Home page:rar.recoverytoolbox.com
- Last updated: August 25th, 2015
EarthView
EarthView is a dynamic desktop wallpaper and screen saver, which displays views of the earth with daylight and night shadows. It produces high resolution images for every screen resolution - even beyond 3840x2160. This program supports map and globe views, urban areas, city lights, atmospheric effects, clouds, weather information, and local time display.
- Publisher: DeskSoft
- Home page:www.desksoft.com
- Last updated: June 16th, 2021
Free RAR Extractor
Free RAR Extractor is a simple tool to help you extract files from RAR, ZIP, 7z, ISO, JAR, LHA, CAB or TAR easily and quickly. Just choose the archive file you want to extract, and click one button, then all the files will be extracted to your specified folder. Save you a lot of precious time.
- Publisher: iWesoft Corporation
- Last updated: October 22nd, 2012
DataNumen RAR Repair
DataNumen RAR Repair (formerly Advanced RAR Repair) is a powerful tool to repair corrupt or damaged RAR and SFX archives. It uses advanced technologies to scan the corrupt or damaged archives and recover your files in them as much as possible.
- Publisher: DataNumen, Inc.
- Home page:www.datanumen.com
- Last updated: February 5th, 2021
Amsterdam Density Functional Adf Program Review
Our flagship computational chemistry program Amsterdam Density Functional (ADF) is particularly strong in understanding and predicting structure, reactivity (catalysis), and spectra of molecules. Density Functional Theory (DFT) calculations are easily prepared and analyzed with our integrated graphical user interface.
ADF is frequently used for studying transition metal complexes and molecules with heavy atoms, since all elements in the periodic table can be modeled accurately and efficiently with the ZORA relativistic approach and Slater Type orbital (STO) all-electron basis sets. With these features, ADF offers unique capabilities to predict molecular properties of nanoparticles and organic electronics materials.
ADF is easy to use with parallel binaries, integrated GUI, and support from experts with decades of experience. The best way to convince yourself is to try out the fully functional Amsterdam Modeling Suite.
X-Ray Absorption Spectroscopy, X-ray photoelectron spectroscopy
SCM’s expert Erik van Lenthe demonstrates how to calculate X-ray absorption spectra (XANES / NEXAFS) with core excitations in ADF. The demo features spin-orbit coupling, TDDFT and the fast transition potential method.
Fedor Goumans has made a video on calculating XPS spectra with ADF.
Transition states
Check out this video on finding transition states with the Amsterdam Modeling Suite, leveraging DFTB as a quick first method (see also Ziegler-Natta tutorial).
Comments are closed.