INT 186AB - TRNSFR EXP SEMINARS - Fall 2023

INT 186AB - TRNSFR EXP SEMINARS - Fall 2023

Course Modules

General

General
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General 119078  
  • Quiz
    Student background feedback Student background feedback
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Syllabus and other general course resources.

Syllabus and other general course resources.
Module Completed Module In Progress Module Locked
Syllabus and other general course resources. 119079  
  • Attachment
    INT186Fa2023.docx Course Syllabus (Oct 2 Week 1, Oct 9 Week 2, etc.) INT186Fa2023.docx Course Syllabus (Oct 2 Week 1, Oct 9 Week 2, etc.)
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Molecular Mechanics

Molecular Mechanics
Module Completed Module In Progress Module Locked
Molecular Mechanics 119080  
  • Attachment
    Molecular Mechanics Principles.pdf Molecular Mechanics Principles.pdf
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Computer lab work resources

Computer lab work resources
Module Completed Module In Progress Module Locked
Computer lab work resources 119081  
  • External Url
    z-matrix - formaldehyde zoom z-matrix - formaldehyde zoom
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  • Attachment
    z-matrix - formaldehyde z-matrix - formaldehyde
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  • Attachment
    1.06 VB and MO theory orbitals in formaldehyde 1.06 VB and MO theory orbitals in formaldehyde
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  • External Url
    1.06 Video of MO theory orbitals in formaldehyde 1.06 Video of MO theory orbitals in formaldehyde
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  • Attachment
    186 protocol.docx 186 protocol.docx
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  • Attachment
    How to Use the Linux Computers.docx How to Use the Linux Computers.docx
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  • Attachment
    Gaussian 2016 Overview.pdf Gaussian 2016 Overview.pdf
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  • Attachment
    Molden.docx Molden.docx
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  • Attachment
    Protocol-yoshi -- This might help you with more detailed instructions for steps in the "186 protocol" above, especially for PC's, but might be a bit out of date Protocol-yoshi -- This might help you with more detailed instructions for steps in the "186 protocol" above, especially for PC's, but might be a bit out of date
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  • Attachment
    General Procedure for Jobs.pdf -- Oct 9 zoom meeting General Procedure for Jobs.pdf -- Oct 9 zoom meeting
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  • Attachment
    Example Calculation - ethane(b).pdf Example Calculation - ethane(b).pdf
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Quantum Mechanics Principles

Quantum Mechanics Principles
Module Completed Module In Progress Module Locked
Quantum Mechanics Principles 119082  
  • Attachment
    Basics of QM and HMO.docx Basics of QM and HMO.docx
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  • Attachment
    Roberts HMO Theory Chapter2.pdf Roberts HMO Theory Chapter2.pdf
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  • Attachment
    Pople Ab Initio QM Theory.pdf Pople Ab Initio QM Theory.pdf
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Assigned Exercises

Assigned Exercises
Module Completed Module In Progress Module Locked
Assigned Exercises 119083  
  • Attachment
    186 Exercise 1. Formaldehyde..docx 186 Exercise 1. Formaldehyde..docx
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  • Attachment
    186 Exercise 2. Formamide and Methylamine..docx 186 Exercise 2. Formamide and Methylamine..docx
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  • Attachment
    186 Exercise 3. DFT and SMD solvation model - 2-pyridone.doc 186 Exercise 3. DFT and SMD solvation model - 2-pyridone.doc
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  • Attachment
    186Exercise 3. DFT and SMD solvation - Example.doc 186Exercise 3. DFT and SMD solvation - Example.doc
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  • Attachment
    186Exercise 3. Historical Background.docx 186Exercise 3. Historical Background.docx
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  • Attachment
    186Exercise2a-hybridization etc.pdf 186Exercise2a-hybridization etc.pdf
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Writing Lewis Structures and Orbital Drawings

Writing Lewis Structures and Orbital Drawings
Module Completed Module In Progress Module Locked
Writing Lewis Structures and Orbital Drawings 119435  
  • Attachment
    Bonding Patterns periodic chart Bonding Patterns periodic chart
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  • Attachment
    1.01 to 1.04 Lewis structures pictures from videos 1.01 to 1.04 Lewis structures pictures from videos
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  • External Url
    1.01 Lewis structures video 1 1.01 Lewis structures video 1
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  • External Url
    1.02 Lewis structures video 2 -- more optional 1.02 Lewis structures video 2 -- more optional
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  • External Url
    1.03 Lewis structures video 3 -- optional 1.03 Lewis structures video 3 -- optional
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  • External Url
    1.04 Lewis structures video 4 -- optional 1.04 Lewis structures video 4 -- optional
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  • Attachment
    1.07-1.08 Lewis structures, resonance, CO, CO2 1.07-1.08 Lewis structures, resonance, CO, CO2
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  • External Url
    1.07 Lewis structures, resonance, CO, CO2 1.07 Lewis structures, resonance, CO, CO2
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Background Papers on Proton Affinity and Carbocations (all Optional material on my research)

Background Papers on Proton Affinity and Carbocations (all Optional material on my research)
Module Completed Module In Progress Module Locked
Background Papers on Proton Affinity and Carbocations (all Optional material on my research) 119084  
  • Attachment
    chem128GBpaper chem128GBpaper
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  • Attachment
    GB,PA alkyl solvation effects GB,PA alkyl solvation effects
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  • Attachment
    carbocationchapter carbocationchapter
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  • Attachment
    Thermodynamics sheet Thermodynamics sheet
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Bifurcation Reactions and other research talks (Optional) - best to download PowerPoint files below to your PC to view them

Bifurcation Reactions and other research talks (Optional) - best to download PowerPoint files below to your PC to view them
Module Completed Module In Progress Module Locked
Bifurcation Reactions and other research talks (Optional) - best to download PowerPoint files below to your PC to view them 119086  
  • Attachment
    PAH talk PAH talk
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  • Attachment
    TEDx2014 TEDx2014
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  • Attachment
    Quantum Reaction Pathways-download powerpoint file to your PC to view it Quantum Reaction Pathways-download powerpoint file to your PC to view it
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minimum score must view must submit must contribute