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Exploring the Nano World: Building Nanoscale Structures with Polymer Modeler
Online Presentations | 14 Jul 2023 | Contributor(s):: Tongtong Shen
In this talk, I will showcase how atomic-level simulations can lead to a more fundamental understanding of PAN crystal structures and guide you through an interactive Polymer Modeler powered by nanoHUB.
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Thermochromic Variable Emittance Coatings for Spacecraft Thermal Control
Online Presentations | 12 Jan 2022 | Contributor(s):: Sydney J. Taylor
Dr. Taylor's research is focused on incorporating a thermochromic insulator-to-metal phase transition material, vanadium dioxide, into nanoengineered coatings to deliver variable heat rejection for spacecraft radiators and structural elements. When the temperature of the spacecraft is above...
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Integrated Computational Materials Engineering in the Classroom: Teaching Fundamental Thermodynamics and Kinetics Through an Industry Focused Lens
Online Presentations | 07 Jan 2022 | Contributor(s):: Adam Hope
This presentation will demonstrate ways that Thermo-Calc can be used in the classroom, as a teaching tool, and in industry, as a research and problem solving tool for any ICME framework.
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Purdue Physical Chemistry Lab CHM37301
Tools | 16 Aug 2021 | Contributor(s):: Michael Earl Reppert
This tool is a front-end for content for the Purdue Physical Chemistry Laboratory CHM37301. It fetches updates automatically from the github.com/mreppert/CHM37301content project.
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Retinal Isomerization
Teaching Materials | 28 May 2021 | Contributor(s):: Christine M Aikens, George C. Schatz, Marcelo Carignano
In this project you will use QC-Lab to examine the isomerization thermodynamics for a number of electronic structure methods and basis sets.
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Thermo-Calc Educational Package
Tools | 23 Mar 2021 | Contributor(s):: Paul Mason, Alejandro Strachan
Thermo-Calc Educational Package
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Molecular Dynamics Simulations for Propulsion Applications
Online Presentations | 26 Aug 2020 | Contributor(s):: Li Qiao
In this talk, Prof. Qiao will discuss the use of molecular dynamics simulations to examine thermodynamics, transport properties, and fluid models of supercritical fuel systems.
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Bridging the Gap Between Large and Small: Thermofluids and Nanoengineering for the Water-Energy Nexus
Online Presentations | 05 Nov 2019 | Contributor(s):: David M. Warsinger
Nanomaterial self-assembly techniques can be guided by thermofluids designs to make macro-scale membrane systems with photonic properties for catalysis and solar distillation.
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Can We Save Lives with Thermodynamics? Nanoengineering and Thermofluids for the Water-Food-Energy Nexus
Online Presentations | 27 Apr 2017 | Contributor(s):: David M. Warsinger
Climate change, degrading water resources, and economic and population growth are increasing the need for new science and technologies at the Water-Energy-Food Nexus. In enabling new and improved technologies to tackle these issues, new nanomaterials designed with systems-level thermodynamics...
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Thermodynamics
Teaching Materials | 17 Jan 2017
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PVLimits: PV thermodynamic limit calculator
Tools | 21 Mar 2016 | Contributor(s):: Mohammad Ryyan Khan, Xin Jin, Muhammad A. Alam
The tool is designed to calculate the thermodynamic performance limit of single-junction and multi-junction solar cells.
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MSE 498 Lesson 18: CALPHAD
Online Presentations | 16 Mar 2015 | Contributor(s):: Andrew Ferguson
This new course will give students hands-on experience with popular computational materials science and engineering software through a series of projects in: electronic structure calculation (e.g., VASP), molecular simulation (e.g., GROMACS), phase diagram modeling (e.g., Thermo-Calc), finite...
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MSE 498 Lesson 19: CALPHAD
Online Presentations | 16 Mar 2015 | Contributor(s):: Andrew Ferguson
This new course will give students hands-on experience with popular computational materials science and engineering software through a series of projects in: electronic structure calculation (e.g., VASP), molecular simulation (e.g., GROMACS), phase diagram modeling (e.g., Thermo-Calc), finite...
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A Python code for material composition lines - composition line utility
Downloads | 11 Sep 2013 | Contributor(s):: Amritanshu Palaria
In material science and chemical thermodynamics, phase diagrams play an important role. In composition-phase diagrams, compositions of the various components constitute, depending on how the composition may change, one or more axes of the diagram. In the sub-space formed by only the composition...
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SugarAid Thermodynamics
Tools | 14 Jan 2010 | Contributor(s):: Prabhakar Marepalli, jason clark
Homework tool for Thermodynamics-I (ME 200)
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Illinois ME 498 Introduction of Nano Science and Technology, Lecture 23: Nanomaterials and Devices for Energy Conversion I
Online Presentations | 23 Dec 2009 | Contributor(s):: Nick Fang, Omar N Sobh
Nanomaterials and Devices for Energy ConversionTopics: Overview of Actuators at Nanoscale Electrostatic Actuators Piezo-Actuators Surface Acoustic Wave Motors Actuator Selection Electrochemical Actuators Solid State Electrochemical Actuator Electrochemical nano-actuator Electrochemical conversion...
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Molecular Sensors for MEMS
Online Presentations | 09 Dec 2009 | Contributor(s):: John P. Sullivan
This seminar will cover the issues involved in using molecular sensors in MEMS and their application to microchannels, supersonic micronozzles, microjet impingement, microturbines and unsteady fluidic actuators.
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The Virtual Kinetics of Materials Laboratory
Tools | 09 Sep 2009 | Contributor(s):: Alex Bartol, Edwin Garcia, David R. Ely, Jon Guyer, Jarrod Lund, Surya Mitra Ayalasomayajula
web interface to develop, modify, and execute FiPy, Gibbs, and other python-based applications
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ECE 495N Lecture 39: Where is the Heating?
Online Presentations | 29 Dec 2008 | Contributor(s):: Supriyo Datta
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Thermoelectric Power Factor Calculator for Nanocrystalline Composites
Tools | 18 Oct 2008 | Contributor(s):: Terence Musho, Greg Walker
Quantum Simulation of the Seebeck Coefficient and Electrical Conductivity in a 2D Nanocrystalline Composite Structure using Non-Equilibrium Green's Functions