Gaussview 6 Tutorial

3CADlogic Draft IT v4. Interactive Blade Design ANSYS BladeModeler defines your design as a number of 2D sketches, either at span-wise or at user-defined positions, to immediately and interactively generate the full 3D design, as well as provide quantitative information such as. This page provides an introductory quick-start tutorial on running an NBO calculation and interpreting the output. gjf outputfile. Start with our tutorials. 01-SMP + GaussView 6. Input example for a diatomic molecule:. GaussView makes it easy to set up many types of Gaussian calculations. Discusses methods for selecting atoms in GaussView 6: They are all recommended for new to intermediate GaussView users. Absortpion spectroscopy • Provide information about presence and absence of unsaturated functional groups • Useful adjunct to IR • Determination of concentration, especially in chromatography • For structure proof, usually not critical data, but essential for further studies • NMR, MS not good for purity. Gaussian & GaussView Tutorial Videos. (2) Draw a benzene ring using the builder (already in icon form). Gaussview 4:file search results 1 - 50 of 10000. Note that it is very important to use the same grid for all calculations where you intend to compare energies e. Gaussian & GaussView Tutorial Videos. Input example for a diatomic molecule:. 2 UsingtheICSD:StartingStructures The ICSD Web database is located aticsd. For people using their own copy of GaussView on their Mac or PC. 5,6, 7 and CS (8) due to the fact my machine is low spec. GaussView 6 may not be compatible with certain versions of the X servers you may run on your desktop or laptop. GaussView 6 Tutorial 1: Building Molecules. Line 7: "0 3" Line 7 consists of two numbers. Note: If you are on subscription, you may no longer need to enter a serial number or product key; you just need to sign in. Gaussian & GaussView Tutorial Videos. What you can view graphically includes: - Optimized molecular structures. Line 6 is blank. Analyzing Natural Bond Orbitals (NBO) results from Gaussian ’03 & ’09 (88) The Gen keyword in Gaussian. 216播放 · 0弹幕 16:58. Geometry Optimization. GaussView: GaussView is the most advanced and powerful graphical interface available for. Pilo Arts, ranked as one of New York's best 5 Color Salons, is the definitive authority on hair, beauty, and wellness in the North East. Actually I've much confusions so to clear all that I need a tutorial and this ain't available on Gaussian website as far as I've searched. Don't worry, you will be properly acknowledged for your. , computing energy differences, heats of formation, and so on. org LONI HPC Workshop Xavier University of Louisiana New Orleans Mar 21, 2012 LONI Programming Environment Mar 21, 2012 LONI HPC Workshop, Xavier University of Louisiana - New Orleans 1 / 52. DEVON FLATS BY COMFORTVIEW® 2PV2757 - SELLING - BLACK FLATS 24184 UK 5,Ricamato Screaming Skull con Indiano Nativo Testa Abito Grande Schiena,Kimono Giapponese Autentico Vero Seta Seta Seta Made in Japan Chirimen Raro. A model is most often a single molecule being worked on in isolation from other ones that may also be open. Then you can start GaussView by typing the command gv. Gaussian 09W Reference Æleen Frisch Gaussian, Inc. GV6 Features at a Glance What's New in GV6 Prices. VRO file, where the VRO contains the media stream information, and the IFO file contains information for chapters, subtitles and audio tracks. 4 / Description Gaussian 09 is the latest in the Gaussian series of programs. This tutorial describes a general procedure for a QM/MM study of a biochemical system using Gaussian and GaussView with the help of the PERL toolkit TAO. sales tax worksheets 7th grade. Gaussian 16 & GaussView 6 Special Topics. Try disabling the desktop effects, if they are on. In cases where PM3 arrives at unreasonable minima, it may be useful to submit directly to ab initio calculations. The Linux kernel itself was 2. Density and contour plots. x) use the savenbo option in the rout section, for example: #P opt HF/6-31G(d) freq=noraman pop=(ful,nboread,savenbo) geom=connectivity. 4 million lines of code, or 8% of the total. Gaussview 6 fails to create a surface, prompting an error: Surface build failed! Processing mesh, No data to plot. It also provides full gaussview 4. Note that it is very important to use the same grid for all calculations where you intend to compare energies e. 1) on your local machine. pdf), Text File (. Overview Gaussian 94 takes a text file with a. 108播放 · 0. The examples/descriptions are inevitably brief and do not aim to be a comprehensive guide. Launch GaussView. Analyzing Natural Bond Orbitals (NBO) results from Gaussian ’03 & ’09 (88) The Gen keyword in Gaussian. E~SpiReS - Tutorial 2 - p-(Methylthio)phenyl Nitronylnitroxide in toluene Step 8: the second and third tags allows to add spin active nuclei (min 1, max 2) to the probe(s). TINKER Manual [PDF} TINKER Web Site for Downloads Force Field Explorer Manual [PDF}. fiz-karlsruhe. James Petersson Schepartz Lab Meeting 03/03/06 Warm up structure while highly restrained. Click on the tutorial topic to obtain more information and registration details. 08 + Nanotube Modeler v1. In cases where PM3 arrives at unreasonable minima, it may be useful to submit directly to ab initio calculations. It also provides full gaussview 4. GaussView (free version) download for PC. You can choose level of theory, basis set, calculation type, etc. Gaussian 16 & GaussView 6 Special Topics. GaussView 6 may not be compatible with certain versions of the X servers you may run on your desktop or laptop. edu with the names of the tutorials that you are interested in attending. Click on the tab that says Carbon Tetrahedral in the middle of the screen using the left mouse button. GaussView computationalmodule front-end/back-endprocessor Gaussian. Here in the interests of speed we will use B3LYP/6-31G* which should be similar to the MP2 result. Gaussian viewer program download found at en. installed SureTrak 3. Changing the Leading Edge 5. 108播放 · 0. gjf outputfile. Select File !Open, and select the formatted checkpoint le for the excited state that you want to visualize the di erence density for in GaussView. " option from the "File" menu. GaussView 教學. Comments on GaussView You can also add comment via Facebook. Quick&Tutorial&onNatural&BondOrder&3&Calculations&WithinGaussian09& Benjamin Rudshteyn, and Victor S. GAUSSIAN 09W TUTORIAL AN INTRODUCTION TO COMPUTATIONAL CHEMISTRY USING G09W AND AVOGADRO SOFTWARE Anna Tomberg anna. We also request additional directional polarization of electron density within the molecule by specifying d-functions for carbon and oxygen atoms. GaussView is the software used to build/view molecules whereas the actual calculations are run in Gaussian suite of programms. Trusted Windows (PC) download GaussView 6. html Click one of the tiles below to read about that feature. GaussView 6. Thermochemistry in Gaussian Joseph W. edu (1) Open Gaussview (version 2. Add hydrogens by checking the View>Hydrogens option ((not needed sometimes, but do it all the same). Virus-free and 100% clean download. The most popular versions among the software users are 5. org, gaussian. Follow the instructions below. Not you must be logged into Knot with an X11 capable program (e. Download Gaussview 5. In this input file, the molecular configuration of the molecule is described as well as the specific calculations that you. Discusses methods for selecting atoms in GaussView 6: This part of the tutorial uses diatomic molecules to try out computational methods, basis-set selection, and spin specification. Interactive Blade Design ANSYS BladeModeler defines your design as a number of 2D sketches, either at span-wise or at user-defined positions, to immediately and interactively generate the full 3D design, as well as provide quantitative information such as. • The calculation is specified by pointing and clicking to build the molecule, and using pull -down menus to select the calculation type, level of theory and basis set. 2 for all of the new modeling methods and features in Gaussian GaussView on Software Informer. It was written primarily to be used by members of the Batista research group at Yale University, but can in principle be used by anyone. GaussView 6 is a chemistry modeling software for the Gaussian 16 program produced by Gaussian, Inc. The examples/descriptions are inevitably brief and do not aim to be a comprehensive guide. GaussView 6. Scojo New York Gels The Original Reading Glasses - Cobalt +1. Discusses methods for selecting atoms in GaussView 6: They are all recommended for new to intermediate GaussView users. Try disabling the desktop effects, if they are on. Comments on GaussView You can also add comment via Facebook. The singlet lies Tutoriql videos may be viewed in any order. This new tutorial is designed to introduce the preparation and analysis of quantum chemistry calculations using Gaussian with GaussView. 40 Wallingford, CT 06492 USA. [email protected] - - Last update: 25 October 2018. GaussView 6 Tutorial 2_ Running Jobs (1) blackhacher. 16 is available as a free download on our software library. SCS-Gaussian-GaussView-tutorial Author: Taras Pogorelov Created Date: 6/11/2013 6:08:15 PM. 1 New Chemistry with Gaussian 16 and GaussView 6 Explore New Substances and Environments: Green Fluorescent Protein GFP is a protein that fluoresces bright green when exposed to light in the blue-to-ultraviolet range. log文件(见图4),就可以生成相应的UV与ECD图谱(见图5),可以将数据导出到Excel里与实验值进行比较(图6),这里不再详细进行叙述。. The page you were looking for doesn't exist Go to the Surfaces and Contours Window. Gaussian 09 64 bit torrent found at gaussian. Specifically, a 6-311+G(d,p) basis set was used which allows for some polarization of electron density on both heavy atoms and hydrogens. Basis Sets; Density Functional (DFT. While GaussView won't display the results directly, one can simply use "Results"=>"Stream Output File" and search for "Total nuclear spin-spin coupling J (Hz)": The three highlighted values are the spin-spin couplings between CH 2 carbon 2 and CH 3 carbons 5, 6, and 7. And to Hacking smart 1 Comment4, 001, 30, told fzh 1 526286, crack BASED 8, bbs0 ge and 1. This new tutorial is designed to introduce the preparation and analysis of quantum chemistry calculations using Gaussian with GaussView. For the associated uncertainty and the number of molecules and frequencies used to determine the vibrational frequency scaling factors see the page XIII. Set up a Gaussian calculation gaussviee the defaults. GaussView 6. The first is the charge and the second is the spin multiplicity. com This is a quick tutorial that will help you to make your way through the. The partial derivative of q t with respect to. Creating an eta-6 ring template in gaussview is. You can do this optimization in a QM package of your choice. GaussView 6 Tutorial 2_ Running Jobs (1) blackhacher. See chapter 9 of [Foresman15] for a detailed tutorial. ) in the molecule or atom. 2 for all of the new modeling methods and features in Gaussian GaussView on Software Informer. James Petersson Schepartz Lab Meeting 03/03/06 Warm up structure while highly restrained. It should be 1. This tutorial will walk you through your first Gaussian calculation. This tutorial is designed for users with some basic experience with Gaussian, GaussView and Unix/Linux systems. The only setting to change is the Spin, from gausview to singlet. The singlet lies Tutoriql videos may be viewed in any order. This tutorial will walk you through your first Gaussian calculation. Electronic Structure calculations in Gaussian It is imperative to preoptimize any geometry using semi-empirical methods (PM3 etc before submitting to ab initio calculations. GaussView6 中的基本分子. Save the N 2 molecule. GAUSSVIEW MANUAL PDF - The GaussView Interface. Serial keys are manual Box 2011. 166播放 · 0弹幕 1:20:30. Features new to GaussView 6 are in blue; features enhanced in GaussView 6 are in green. Discusses methods for selecting atoms in GaussView 6: MO 7 will appear in the Surfaces Available list and will appear in the View window. They even describe the motion of matter at the atomic level. The first is the charge and the second is the spin multiplicity. Download Presentation Gaussian & GaussView An Image/Link below is provided (as is) to download presentation. 科技 野生技术 13. 02 using mp2 method and cc-aug-pvqz basis set. So, now try your hand at the Formaldehyde example in the manual. This gives a density plot of sin(x) sin (y). Gaussian 16 & GaussView 6 Special Topics. Todas las versiones tienen las características científicas y de modelado, y ninguna impone limitaciones artificiales a los cálculos ,aparte de la potencia de la máquina en la que se use. internationers. Download Presentation Introduction to Gaussian and GaussView An Image/Link below is provided (as is) to download presentation. While GaussView won't display the results directly, one can simply use "Results"=>"Stream Output File" and search for "Total nuclear spin-spin coupling J (Hz)": The three highlighted values are the spin-spin couplings between CH 2 carbon 2 and CH 3 carbons 5, 6, and 7. GaussView 6. All three couplings are different, due to the different internuclear distances. 6 2019-May-21. This new tutorial is designed to introduce the preparation and analysis of quantum chemistry calculations using Gaussian with GaussView. Important Notes. Machine learning - Bayesian optimization and multi-armed bandits. GaussView is an advanced graphical user interface designed to be used with Gaussian to make calculations easier, quicker, and more efficient. Well ordered guide how to download,install and initiate your MS Office 365, Office 2016,etc. So, now try your hand at the Formaldehyde example in the manual. 7 Now that you can see the two carbons, choose the Mouse Label Bonds menu item from the VMD Main menu. The software belongs to Education Tools. Add hydrogens by checking the ‘View>Hydrogens’ option ((not needed sometimes, but do it all the same). A portable, multi-platform, command-line driven graphing utility. The singlet lies Tutoriql videos may be viewed in any order. sales tax worksheets 7th grade. The Magic of Movies A GROMACS Tutorial E. 12 Löffel Kaffee Versilbertes Metall Modell Uniplat Fahnen Set mit Wappen,Türrahmen Fotos 4 Foto Geschrieben Familie Familie Brokat Weiß PVC Haus 664,SITZENDER GANESHA ELEFANTENGOTT AUS INDIEN 1,5 KG 18 CM HOCH BUDDHA MESSINGGUSS. 08 + Nanotube Modeler v1. Gaussian 03 Winodws Tutorial - Free download as PDF File (. Trusted Windows (PC) download GaussView 6. 6 In the Graphical Representations window, create a representation for the selection index 770 1242, with VDW as drawing method. GaussView computationalmodule front-end/back-endprocessor Gaussian. Batista* victor. tricadluhand1980. While GaussView won't display the results directly, one can simply use "Results"=>"Stream Output File" and search for "Total nuclear spin-spin coupling J (Hz)": The three highlighted values are the spin-spin couplings between CH 2 carbon 2 and CH 3 carbons 5, 6, and 7. GAUSSVIEW MANUAL PDF - The GaussView Interface. A model is most often a single molecule being worked on in isolation from other ones that may also be open. This toluene description and gaussview 5. Line 6 is blank. Gaussview 6 Crack. fiz-karlsruhe. The various models in a model group can be animated by pressing the green button in the toolbar. ArcMap has a range of color ramps already defined in the Color Ramp styles folder of the ESRI style. Arvin_YuFei. 2 UsingtheICSD:StartingStructures The ICSD Web database is located aticsd. Suretrak Project Manager 3. I've worked in the industrial enviroment for about 2 years prior to transferring to education in 2013. *4 To operate this software, Gaussian09 Rev. 7 Now that you can see the two carbons, choose the Mouse Label Bonds menu item from the VMD Main menu. GaussView is a great and well defined graphical interface and reproduction for Gaussian and everything it produces. GaussView 6. 00 Magnification 772195401749,(Porcelain) - Jolie Cosmetics Mineral Liquid Powder Foundation (Porcelain),Spring Hinge Plastic Reading Glasses (5 Pack Mix) Includes Sun Readers Women. Introduces the fundamentals of using GaussView 6: Each one focuses on a specific Gaussian capability and the GaussView features that support it. Download Gaussview 5. In the GaussView GUI, build a Tolune molecule following the instruction at [4]. GaussView 6. If you encounter problems, these can often be overcome by starting GaussView with the command gv -mesagl or gv -soft. Gaussian 16 & GaussView 6 Special Topics. Each one focuses on a specific Gaussian capability and the GaussView features that support it. GaussView 6 Tutorial. anwerd8 November 15th, 2016 Chasm Consulting VentSim Premium Design v5. Changing the Leading Edge 5. In this chapter of The Physics Classroom Tutorial, we will make an effort to understand vibrational motion and its relationship to waves. A portable, multi-platform, command-line driven graphing utility. Condition is New with tags. When to Contact the HPC Help Desk: Users should contact the HPC Help Desk when assistance is needed for unclassified problems, issues, or questions. This is a series of tutorials designed to cover the basics of performing routine calculations in Gaussian. com This is a quick tutorial that will help you to make your way through the. Creating an eta-6 ring template in gaussview is. • The calculation is specified by pointing and clicking to build the molecule, and using pull -down menus to select the calculation type, level of theory and basis set. ) in the molecule or atom. If you want to find out more about the NBO analysis (this is OPTIONAL) go to the NBO web-site The information can be quite technical, but the beginners tutorial provides a good starting point. Note that it is very important to use the same grid for all calculations where you intend to compare energies e. Scojo New York Gels The Original Reading Glasses - Cobalt +1. freedownloadmanager. Precomputed vibrational scaling factors The following tables list the vibrational frequency scaling factor as determined from data in the CCCBDB. Download Presentation Using Gaussian & GaussView on CHPC Resources An Image/Link below is provided (as is) to download presentation. 166播放 · 0弹幕 1:20:30. It provides state-of-the-art capabilities for electronic structure modeling. Gaussian 16 & GaussView 6 Special Topics. For example, you can enter the name of the. Analyzing Natural Bond Orbitals (NBO) results from Gaussian ’03 & ’09 (88) The Gen keyword in Gaussian. GaussView 6 is the latest iteration of a graphical interface used with Gaussian. Please refer to HPC VMD Guide and VMD Protein Simulation tutorial [6]. 8 suggestions follow Taras Pogorelov's tutorial. Pacheco User Services Consultant LSU HPC & LONI [email protected] This tutorial will walk you through your first Gaussian calculation. Gradually release restraints. This page contains descriptions and links for all of the tutorial videos we have. 68 kcal/mol. 6 In the Graphical Representations window, create a representation for the selection index 770 1242, with VDW as drawing method. The videos are available on YouTube and can be viewed prior to or synchronously as students are acquiring an IR spectrum, processing an 1H NMR spectrum, or performing specific calculations using GaussView. A member of Intercoiffure and ISPA, Pilo Arts' hair color specialist are the leading hair color artists in the country. All of our videos are on our YouTube channel. Working with Spectra Demonstrates the basics of building molecules in GaussView: The energy unit "au" stands for the atomic unit of energy, which is Hartrees. Guidance to use GaussView 5 in an interactive session with Gaussian appears below. CONFLEX Output with GaussView. Trusted Windows (PC) download GaussView 6. Select File !Open, and select the formatted checkpoint le for the excited state that you want to visualize the di erence density for in GaussView. GAUSSVIEW MANUAL PDF - The GaussView Interface. The GaussView interface features include easy Gaussian calculation set up and three dimensional molecular modeling. The main GaussView interface consists of several windows, in addition to other dialogs which appear in the course of working. GaussView画图技巧. Be sure to have your laboratory notebook ready to record the progress of this exercise. 19 Glass 19 JH Vase Hyacinth Denmark Hyacinth Vase Vase Grid= grid-name Specifies the integration grid to be used for numerical integrations. The videos can be viewed in any order. Gradually release restraints. Gaussian viewer program download found at en. 9 - best software for Windows. 6 In the Graphical Representations window, create a representation for the selection index 770 1242, with VDW as drawing method. You can have 30-day money back guarantee. pdf), Text File (. Get the Gassian GaussView Student Computing Policies - ocio osu Description of Gaussian Instructor: Course: Date: Gaussian/GaussView Student Computing Policies We the undersigned agree to abide by the following policies regarding the use of Gaussian/GaussView (the software) on department. It should be 1. In this Video: Simple Calculation running in Gaussian 09 Shown about : 1) Constructing a molecule using GaussView 6. GaussView 5: Visualizacin y. In the case that cube files for selected orbitals have already been generated for use with other visualization programs, these can also be read with GaussView using the "Open. In computational jargon, the molecule was optimized at the MP2/6-311+G** level. First, through its advanced visualization facility, GaussView allows you rapidlysketch evenvery large molecules, rotate,translate moleculesthrough simple mouse operations. 16 Overview. GAUSSVIEW TUTORIAL PDF - This is a quick tutorial that will help you to make your way through the first steps of computational chemistry using Gaussian 09W software (G09). 2 for all of the new modeling methods and features in Gaussian GaussView on Software Informer. GaussView offers you an advanced visualization facility. The various models in a model group can be animated by pressing the green button in the toolbar. Minimize water molecules before. It also provides full gaussview 4. WebMO is a free World Wide Web-based interface to computational chemistry packages. Gaussian viewer program download found at en. Registax Tutorial. Gaussian 16 y GaussView 6. If I click on the workspace, the window is activated and I can see whatever I have drawn but in 1sec it goes again. com extension as an input. Discusses methods for selecting atoms in GaussView 6: This part of the tutorial uses diatomic molecules to try out computational methods, basis-set selection, and spin specification. gaussview 4. Discusses methods for selecting atoms in GaussView 6: Interaction with molecules is designed around the movements gaussciew a three mouse. Gaussview/Gaussian Guide and Exercise Manual Introduction In this manual some of the principal features of the Gaussview and Gaussian programs are highlighted to enable the student to start working productively with both programs. Gaussian & GaussView Tutorial Videos. c on my new PC with Windows 7. You can using the Graphical interface Gaussview on Knot with the command 'gv'. This toluene description and gaussview 5. 2 main window’s Calculate menu. GaussView offers you an advanced visualization facility. Follow the instructions below. Pacheco User Services Consultant LSU HPC & LONI [email protected] GaussView 6 Tutorial 2_ Running Jobs (1) blackhacher. This tutorial describes a general procedure for a QM/MM study of a biochemical system using Gaussian and GaussView with the help of the PERL toolkit TAO. It calculates the MO compositions in terms of the constituent chemical fragments (you can specify them as atoms, groups of atoms, atomic orbitals, fragment molecular orbitals, groups of atomic orbitals, etc. The program's installer file is commonly found as gview. Gaussview may is a format change for the opt=modredundant keyword in. Student surveys indicate preference for the animated tutorials over conventional paper instructions and general favorability of the videos. In the event that you have discover any issue in making your Office account, at that point visit office my account this site certainly causes you. DEVON FLATS BY COMFORTVIEW® 2PV2757 - SELLING - BLACK FLATS 24184 UK 5,Ricamato Screaming Skull con Indiano Nativo Testa Abito Grande Schiena,Kimono Giapponese Autentico Vero Seta Seta Seta Made in Japan Chirimen Raro. 08 + Nanotube Modeler v1. *1 Checked by GaussView 5. Discusses methods for selecting atoms in GaussView 6: Describes convenience features for G16 job setup: Covers examining basic results from Gaussian calculations: Discusses setting up and running Gaussian jobs with GaussView: We always announce new videos on our LinkedIn blog and our Twitter. Machine learning - Bayesian optimization and multi-armed bandits. Input example for a diatomic molecule:. Follow the instructions below. Download Policy: Content on the Website is provided to you AS IS for your information and personal use and may not be sold / licensed / shared on other websites without getting consent from its author. The first is the charge and the second is the spin multiplicity. GaussView (free version) download for PC. Mac X11, the NX client, etc. GaussView 教學. A member of Intercoiffure and ISPA, Pilo Arts' hair color specialist are the leading hair color artists in the country. The videos in this series are for beginning users of GaussView. Look at most relevant Gaussian 09 64 bit torrent websites out of 10. AOMix is a user-friendly software for the molecular orbital (MO) analysis. Shickadance May 6 '11 at 17:41. Introduces the fundamentals of using GaussView 6: Each one focuses on a specific Gaussian capability and the GaussView features that support it. *3 Not guaranteed to all operating environment. The figure below shows the GaussView setup for the time-dependent DFT calculation. Tutorial: Using VMD [PDF} Spartan Molecular Modeling (Q-Chem) Spartan Student Overview [PDF} Spartan '10 Manual [PDF} Q-Chem 4. Quick&Tutorial&onNatural&BondOrder&3&Calculations&WithinGaussian09& Benjamin Rudshteyn, and Victor S. Demonstrates the basics of building molecules in GaussView: The title bar of each view window displays information about the current model group, model and view: Each one focuses on a specific Gaussian capability and the GaussView features that support it. 6 In the Graphical Representations window, create a representation for the selection index 770 1242, with VDW as drawing method. • The calculation is specified by pointing and clicking to build the molecule, and using pull -down menus to select the calculation type, level of theory and basis set. Download Policy: Content on the Website is provided to you AS IS for your information and personal use and may not be sold / licensed / shared on other websites without getting consent from its author. This tutorial will explore the construction of a path model for social science research. com file generated by GaussView, when you use the graphics. 7 Now that you can see the two carbons, choose the Mouse Label Bonds menu item from the VMD Main menu. The only setting to change is the Spin, from triplet to singlet. All three couplings are different, due to the different internuclear distances. You can choose level of theory, basis set, calculation type, etc. GaussView makes it easy to examine the results of one calculation and then set up and initiate the next calculation in sequence via an intuitive interface to all major Gaussian 16 features. In the GaussView GUI, build a Tolune molecule following the instruction at [4]. Gaussian入门教程(一). Click the play icons to view videos demonstrating the. The software belongs to Education Tools.