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HyperChem in Chemical Engineering

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  • Outline ImageCourse Outline
  • Scheduled ImageScheduled Dates

Course Overview

This comprehensive training program offers in-depth knowledge and practical expertise in utilizing HyperChem, a powerful molecular modelling and simulation software widely used in chemical engineering and chemistry. The course covers the full range of HyperChem's capabilities, focusing on building complex chemical models, simulating physical and chemical processes, and analysing molecular structures. Designed for scientists, engineers, and researchers, this program provides the skills to create accurate chemical simulations and develop high-quality research outcomes for academic and industrial applications.

Objective:

By the end of the course, participants should have: 

  •   A complete understanding of HyperChem’s capabilities
  •   Gained expertise in building complex chemical systems
  •   Knowledge on simulating physical and chemical processes
  •   Knowledge on obtaining high accuracy predictions of atomic/ molecular properties
  •   The ability to use HyperChem to generate high quality research results for scientific publications or/ and industrial applications
  •   Built their own chemical models/ systems
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Course Outline

Day 1: Fundamentals of 3D Molecular Modelling

  • Introduction to HyperChem's Graphical User Interface (GUI)
  • Utilizing the periodic table for chemical structure creation
  • Auto-build functions for generating molecular models
  • Building and visualizing 3D chemical structures
  • Understanding the structural characteristics of molecules
  • Moving, translating, and applying constraints on chemical structures

Day 2: Chemical and Electronic Properties in Molecular Systems

  • Analysis of chemical characteristics of molecular structures
  • Evaluation of electronic properties in molecular modelling
  • Designing and modelling polymers and macromolecules
  • Creation of new chemical substances for simulation
  • Investigating molecular energies and conformations

Day 3: Advanced Computational Methods and Simulation Techniques

  • Molecular Dynamics simulations for studying molecular behaviour
  • Monte Carlo simulations for complex chemical systems
  • Ab Initio methods for accurate quantum mechanical calculations
  • Density Functional Theory (DFT) applications in molecular modelling
  • Semi-empirical force fields for faster computational modelling
  • Utilizing available basis functions for various simulations
  • Geometry optimization techniques for energy minimization
  • Recording simulations and capturing snapshots for analysis

Day 4: Applications in Chemical Engineering and Materials Science

  • Hydrogen adsorption modelling in porous carbonaceous adsorbents
  • CO2 removal simulations in porous solid materials
  • Catalysis process modelling and reaction mechanisms
  • Protein folding simulations for biological systems
  • Solvation modelling and water molecule interactions
  • Membrane selectivity and permeability analysis
  • Gas diffusion on porous solid surfaces

Day 5: Advanced Materials, Nanotechnology, and Environmental Applications

  • Optoelectronic property analysis of advanced polymers
  • Gas mixing behaviour in complex molecular systems
  • Elastic behaviour analysis of polymers at the atomistic scale
  • VOC removal simulations using MIPs, activated carbons, and carbon allotropes
  • Modelling of novel carbon structures: Graphene, Fullerenes, and Nanotubes
  • Developing advanced chemical models for research and industrial projects
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Schedule & Fees

3 For 2Offer

Get the most out of group training with our special discount! Register 3 of your participants together on the same course and only pay for 2.

Select Month

  • All
  • July
  • September

Location

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  • London london icon

Duration: 5 Days

date: 21 - 25 Jul 2025

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Duration: 5 Days

date: 08 - 12 Sep 2025

Register Now
  • Chemical Engineering

HyperChem in Chemical Engineering

Duration:5 Days

date:08 - 12 Sep 2025

London

London

$5,900


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    Our courses are delivered by highly experienced industry experts

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    Recognition

    All our courses are accredited by the CPD Standards Agency

Frequently Asked Questions

How can training courses be used as a company benefit?

Training is hugely beneficial to both yourself and your company. It enables you to employ new technologies, increases your productivity and enables you to be more autonomous. Have a look here at our infographic on the importance of training and development!

How often do you update your course content to ensure relevancy?

Our course content is constantly reviewed and updated to ensure we stay up to date with all the latest trends. After every course is completed we review the feedback and improve the material where necessary.

Do you keep your classroom environment and instructional methodologies current with today’s real-world workplace?

Yes, we focus our training on ‘real-world’ scenarios and our trainers are all highly experienced and skilled in their relevant fields.

Are your courses eligible for professional certification?

Yes, we offer certification with all our courses, every course is entitled to CPD (Continuous Professional Development) hours which you can put towards your professional portfolio.

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HyperChem in Chemical Engineering

  • United KingdomLondon
  • calendar08 - 12 Sep 2025
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  • United KingdomLondon
  • 08 - 12 Sep 2025
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