This is the Windows app named QMForge to run in Windows online over Linux online whose latest release can be downloaded as QMForge-2.2.tar.gz. It can be run online in the free hosting provider OnWorks for workstations.
Download and run online this app named QMForge to run in Windows online over Linux online with OnWorks for free.
Follow these instructions in order to run this app:
- 1. Downloaded this application in your PC.
- 2. Enter in our file manager https://www.onworks.net/myfiles.php?username=XXXXX with the username that you want.
- 3. Upload this application in such filemanager.
- 4. Start any OS OnWorks online emulator from this website, but better Windows online emulator.
- 5. From the OnWorks Windows OS you have just started, goto our file manager https://www.onworks.net/myfiles.php?username=XXXXX with the username that you want.
- 6. Download the application and install it.
- 7. Download Wine from your Linux distributions software repositories. Once installed, you can then double-click the app to run them with Wine. You can also try PlayOnLinux, a fancy interface over Wine that will help you install popular Windows programs and games.
Wine is a way to run Windows software on Linux, but with no Windows required. Wine is an open-source Windows compatibility layer that can run Windows programs directly on any Linux desktop. Essentially, Wine is trying to re-implement enough of Windows from scratch so that it can run all those Windows applications without actually needing Windows.
SCREENSHOTS
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QMForge to run in Windows online over Linux online
DESCRIPTION
QMForge reads output from various quantum mechanical calculations and provides tools for analyzing these results. Specifically, population (Mulliken and C-squared), fragment, and charge decomposition analyses are available.See https://qmforge.net for more info.
Features
- Analyze electronic structure (Mulliken, C-squared, and Lowdin Population Analyses)
- Mayer's Bond Orders
- Charge Decomposition Analysis (CDA)
- Fragment Analysis
- Extract the steps along a geometry optimization
- Animate the Normal Modes of a frequency calculation and save as an animated GIF
- Plot and save the energies/intensities of a frequency calculation
- Plot and save the results of an Excited State (e.g. TD-DFT) calculation
Audience
Science/Research
User interface
OpenGL, Qt
Programming Language
Python
This is an application that can also be fetched from https://sourceforge.net/projects/qmforge/. It has been hosted in OnWorks in order to be run online in an easiest way from one of our free Operative Systems.
