GaussSum 2.1.6 Crack + Free Download [Win/Mac] 2022 Introducing GaussSum, an open source software application designed to help you analyze, extract and monitor the progress of SCF cycles, geometry optimization, UV-Vis/IR/Raman spectra, MO levels, and MO contributions. GaussSum is designed to help you: - analyze, extract and monitor the progress of SCF cycles, geometry optimization, UV-Vis/IR/Raman spectra, MO levels, and MO contributions - help you analyze and extract data from computer-generated files in.LOG,.OUT,.ADFOUT,.GAMESSOUT,.GAMESS-UKOUT,.JAG,.TAM,.TGA,.GTO,.JAGOUT,.GA,.GAMESS,.GAMESS-UK,.PC GAMESS,.X,.CIF,.SII,.RESI,.RESF,.SDF and.RESIOUT files - help you analyze and extract data from files generated by Gaussian, Jaguar, PC GAMESS, Gaussian-UK, and ADF - help you to optimize the SCF convergence and geometry - plot, list and extract vibration spectra and detailed results of molecular orbitals, MO contributions and electronic transition - display and plot molecular orbital and MO contributions, as well as electronic transitions of individual atoms/groups - display and plot single point and one-dimensional spectra - display and extract cross sections and angular distributions - perform search and plot frequency spectra - plot, list and extract electronic transitions - analyze, plot and extract error messages - automate or control the SCF convergence and geometry optimization processes - monitor the progress of SCF convergence and geometry optimization - determine the chemical shift values and geometry of the structure - integrate into your workflow to help you analyze, extract and monitor the progress of SCF cycles, geometry optimization, UV-Vis/IR/Raman spectra, MO levels, and MO contributions - analyze, extract and monitor the progress of SCF cycles, geometry optimization, UV-Vis/IR/Raman spectra, MO levels, and MO contributions It is intended to be used as a stand-alone application that works fine on Linux, Windows and OS X. Requirements: - GNU/Linux (Fedora and Ubuntu are supported) - Python version 2.7 - Python version 3.x - at least 1GB RAM - at least GaussSum 2.1.6 Crack + Incl Product Key For PC GaussSum is a software application specialized in parsing the output files of ADF, GAMESS, GAMESS-UK, Gaussian, Jaguar and PC GAMESS calculations in order to extract useful data. The advantages of being portable This is a portable program that can be run on your computer without having to go through installation steps. Plus, it doesn’t leave any entries in the Windows registry. You may copy it on any USB flash drive or other devices and take it with you whenever you need to analyze the output of ADF and GAMESS files. User interface GaussSum adopts a clean and intuitive layout that allows you to tweak the dedicated parameters with minimal effort. Files can be imported in the working environment using the built-in browse button, so you cannot rely on the drag-and-drop support. You are allowed to import data from OUT, LOG or ADFOUT file format, and the tool can also handle compressed log files, such as ZIP, GZ and BZ2. Plotting and extracting data options GaussSum is able to reveal all lines including a certain phrase, monitor the progress of SCF convergence and geometry optimization, display molecular orbital information (contributions of groups of atoms to the molecular orbits), as well as extract data about IR and Raman vibrations. When it comes to plotting options, you are allowed to plot the density of state spectrum (as well as partial density of states when dealing with groups of atoms), crystal orbital overlap population (COOP) spectrum (in order to view data about the bonding/anti-bonding nature of an overlap between atoms/groups), UV-Vis spectrum and the circular dichroism spectrum, as well as IR and Raman spectra (you can make use of general and individual scaling parameters). Last but not least, you can view error messages and configure several settings related to search terms, frequencies, orbitals as well as electronic transitions. Bottom line All in all, GaussSum comes with the right tools for helping you analyze, extract and monitor the progress of SCF cycles, geometry optimization, UV-Vis/IR/Raman spectra, MO levels, and MO contributions. Download 1a423ce670 GaussSum 2.1.6 Torrent (Activation Code) - '#': Comment - '!': Extra lines - '@': User-defined keywords - '1': Data Type (density of state, COOP, polarizability... etc.) - '2': Import mode: - '3': Import mode: - '4': Import mode: - '5': Import mode: - '6': Import mode: - '7': Import mode: - '8': Import mode: - '9': Import mode: - '0': Import mode: - ';': Continue - '+': Continue - '-,': Continue - '*': Continue - '1': Start repeating data mode - '2': Start repeating data mode - '3': Start repeating data mode - '4': Start repeating data mode - '#': End repeating data mode - '5': Start repeating data mode - '6': Start repeating data mode - '0': Start repeating data mode - '.': End repeating data mode - ';': Continue - '+': Continue - '-': Continue - '*': Continue - '1': Start repeating data mode - '2': Start repeating data mode - '3': Start repeating data mode - '4': Start repeating data mode - '0': Start repeating data mode - '.': End repeating data mode - ';': Continue - '1': Start repeating data mode - '2': Start repeating data mode - '3': Start repeating data mode - '4': Start repeating data mode - '0': Start repeating data mode - '.': End repeating data mode - ';': Continue - '#': Comment - '!'': Extra lines - '@': User-defined keywords - '1': Data Type (density of state, COOP, polarizability... etc.) - '2': Import mode: - '3': Import mode: - '4': Import mode: - '5': Import mode: - '6': Import mode: - '7': Import mode: - '8': Import mode: - '9': Import mode: - '0': Import mode: - ';': Continue - '+': Continue - '-,': Continue - '*': Continue - '1': Start repeating data mode What's New in the? System Requirements For GaussSum: Controller Required: R4 Windows: Windows 7 or higher, 64-bit Processor: Intel Core 2 Duo or equivalent, 2.0 GHzMemory: 2 GB or moreMemory: 4 GB or moreGraphics: NVIDIA GeForce 8800 or AMD Radeon HD 3870DirectX: Version 9.0cVideo Card: 1024 x 768 or higher with hardware accelerated video such as NVIDIA GeForce 8800 or AMD Radeon HD 3870, 2 GB RAM or moreHard Drive: 10 GB or more (11 GB or more recommended) Mac:
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