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Density functional theory scilab in Title/Summary

Amsterdam Density Functional (ADF) Program

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
Dacapo

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
Scilab

Scilab

Scilab is a mathematical computing program similar to MATLAB. It includes a graphical circuit designer and simulation tool called Xcos - this is similar to Simulink in MATLAB, but with less features. Scilab is an excellent tool for anyone to solve optimization problems. You can download additional toolboxes from the developer site.

  • Publisher: Scilab Enterprises S.A.S
  • Home page: www.scilab.org
  • Last updated: April 17th, 2020

Density functional theory scilab in Description

GAMESS for Microsoft Windows 32-Bit

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.

SciLab CAPE-OPEN Unit Operation

SciLab CAPE-OPEN Unit Operation

The SciLab CAPE-OPEN Unit Operation is a unit operation implementation for which the calculations can be entered in SciLab. To get started with the SciLab CAPE-OPEN unit operation, start your CAPE-OPEN capable simulation environment and insert a SciLab CAPE-OPEN unit operation. Edit a unit operation.

FFTW Library for scilab-5.1.1

FFTW Library for scilab-5.1.1

FFTW Library for scilab-5.1.1 provides a set of fftw functions. This is a scilab interface for fftw library v.3. It provides a set of fftw functions. Both source and pre-compiled library of interface are provided (linux and windows). Scilab documentation is also provided. FFTW is a GPL software, developed by Matteo Frigo and Steven G. Johnson.

  • Publisher: Matteo Frigo
  • Last updated: March 22nd, 2012
SciLab CAPE-OPEN Thermo Import

SciLab CAPE-OPEN Thermo Import

This SciLab package allows for importing CAPE-OPEN thermodynamic and physical Property Packages into SciLab. A command driven package allows for selecting a CAPE-OPEN Property Package, and then perform thermodynamic and physical property calculations as well as thermodynamic equilibrium calculations inside SciLab.

Musical Palette - Melody Composing Tool

Musical Palette - Melody Composing Tool

Musical Palette - Melody Composing Tool 3.7

  • Publisher: Ilya Schepikhin
  • Last updated: September 28th, 2008

Additional Density functional theory scilab selection

Spartan '16

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
Tom Clancy's Splinter Cell Chaos Theory

Tom Clancy's Splinter Cell Chaos Theory

Splinter Cell Chaos Theory is the third game in the Splinter Cell franchise. Picking up where the previous game left off, Chaos Theory takes on the features that made its predecessor a great game. The visuals are stunning for a 2005 game. The lightning effects are probably the best. The game is all about stealth.

EarthView

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.

The Official DSA Theory Test for Car Drivers

The Official DSA Theory Test for Car Drivers

Prepare to pass your theory test first time with this fully revised edition of the best-selling theory test software. The Official DSA Theory Test for Car Drivers includes every official theory test revision question and answer with the full DSA explanations to help you fully understand the theory behind each answer.

  • Publisher: Learnerstuff
  • Last updated: January 27th, 2012
Driving Theory Test Express

Driving Theory Test Express

Passing driving theory test is an important step toward throwing away your L-plates. It is necessary to pass driving theory test before applying for practical test. If you are preparing for your driving theory test, it is important that you study all the latest official revision theory test questions published by DSA.

  • Publisher: Oasis Softwares Ltd.
  • Last updated: March 31st, 2012
Driving Theory Test

Driving Theory Test

Features: -Latest official DSA driving theory test 2010/11 questions with case study style questions -Practice all official DSA car and motorcycle questions from which actual exam questions are chosen -Unlimited random mock theory tests -Fully interactive over 70 hazard perception clips -The highway code - complete digital version with road signs and markings

  • Publisher: Oasis Softwares Ltd.
  • Last updated: September 22nd, 2011
LDC Theory Test Complete

LDC Theory Test Complete

14 new mock Theory Tests specially designed to cover just the key official questions or unlimited randomly generated tests to make absolutly certain you are ready for this part of the test. Looks and feels just like the real test with a properly balanced set of Official DSA questions.

ATC for Splinter Cell Chaos Theory

ATC for Splinter Cell Chaos Theory

The Advanced Tactical Center now comes included in the game. You will be able to design new strategies, discuss them with your team and have them available. Take full advantage of all the tools provided, the strategic areal views will help your team to plan ahead.

  • Publisher: Foolish Entertainment AB
  • Last updated: March 1st, 2008
Functional Ear Trainer - Basic

Functional Ear Trainer - Basic

Functional Ear Trainer - Basic is a simple, yet powerful ear training application to help you unlock your inner ear. Its concept is different from traditional ear training programs that let you guess intervals or pretend to teach you perfect pitch. The program will play a chord sequence to establishes the key or tonality.

  • Publisher: Alain Benbassat
  • Last updated: May 9th, 2008
Internet Download Manager

Internet Download Manager

Internet Download Manager supports proxy servers, FTP and HTTP protocols, firewalls, redirects, cookies, authorization, MP3 audio and MPEG video content processing. IDM integrates seamlessly into Microsoft Internet Explorer, Netscape, MSN Explorer, AOL, Opera, Mozilla, Mozilla Firefox, Mozilla Firebird, Avant Browser, MyIE2, and all other popular browsers to automatically handle your downloads.