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Katherine Hollingsworth
Jan 102 min read
Exploring Delocalized Bonding in Benzene with MedeA VASP: A Powerful Tool for Analyzing Chemical Systems
MedeA VASP makes it easy to analyze and understand chemical bonding. By leveraging the integrated MedeA Environment you can quantify the...
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Katherine Hollingsworth
Jan 104 min read
Easily Create and Publish Materials Simulation Custom Protocols with MedeA Flowcharts
At-a-Glance: MedeA Flowcharts make it easy to design and conduct systematic computational materials science studies with a visual...
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Katherine Hollingsworth
Dec 18, 20248 min read
MedeA Software Release MedeA 3.10 -- Multiscale!
MedeA 3.10 offers an integrated suite of multiscale modeling capabilities with advanced features that empower researchers to explore and des
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Katherine Hollingsworth
Dec 6, 20242 min read
Upcoming: MedeA VASP Training - Did You Miss the First Training?
Upcoming MedeA VASP Training Materials Design announces an online training session featuring MedeA, the industry-leading atomistic...
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Katherine Hollingsworth
Dec 3, 20242 min read
Materials Design to Present at 2024 MRS Fall Meeting in Boston, MA
Machine-Learned Potentials for Studying Corrosion, Embrittlement, and Phase Transitions in Zirconium”, will demonstrate the powerful capabil
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Katherine Hollingsworth
Nov 12, 20242 min read
A Dual-cutoff Machine-learned Potential for Condensed Organic Systems Obtained via Uncertainty-guided Active Learning
This significant work explores the innovative application of machine-learned potentials (MLPs) to improve the accuracy and efficiency of pr
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Katherine Hollingsworth
Oct 8, 20244 min read
The MedeA AI Platform for Materials Science - Leading the Way in Materials Innovation
In this article, we explore the impact of artificial intelligence (AI) on computational materials science and describe the evolution of...
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Katherine Hollingsworth
Oct 1, 20242 min read
Announcing the Online 2024 Materials Design MedeA User Group Meeting (UGM)
Registrations are Open for the Online 2024 MedeA User Group Meeting
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Katherine Hollingsworth
Sep 18, 20242 min read
DCS Computing GmbH and Materials Design, Inc. Announce Collaboration
DCS Computing GmbH and Materials Design, Inc. Announce Collaboration
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Katherine Hollingsworth
Sep 9, 20242 min read
Protecting the Environment with the Polymer Expert
Polypropylene straws survive in the environment for decades, endanger wildlife, and eventually release harmful chemicals as they decompose.
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Katherine Hollingsworth
Sep 2, 20242 min read
Webinar: Materials Design presents an interview with a pioneer in computational materials design: Prof. Gregory B. Olson
Materials Design presents an interview with a pioneer in computational materials design: Prof. Gregory B. Olson
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Katherine Hollingsworth
Aug 27, 20242 min read
Understanding and Predicting Hydrogen Embrittlement in Metals Demonstrates the Predictive Power of MLPs for Complex Metallurgical Phenomena
Understanding and Predicting Hydrogen Embrittlement in Metals Demonstrates the Predictive Power of MLPs for Complex Metallurgical Phenomena
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Katherine Hollingsworth
Aug 23, 20242 min read
Upcoming: MedeA VASP Training
MedeA VASP Training: Experience the ease with which atomistic models may be constructed and VASP simulations may be launched, monitored, and
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Katherine Hollingsworth
Aug 9, 20242 min read
Alexander Mavromaras and René Windiks to Represent Materials Design at Oslo Battery Days Conference 2024
Dr. Mavromaras will deliver a presentation titled “Advancing Battery Technology with Modeling Insights: From Active Materials to Cell"...
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Katherine Hollingsworth
Jun 25, 20241 min read
Erich Wimmer to Keynote at 5th Aspherix & CFDEM Conference in Vienna
Erich Wimmer to Keynote at 5th Aspherix & CFDEM Conference in Vienna
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Katherine Hollingsworth
Jun 21, 20241 min read
University of Kazan Develops Highly Accurate Machine-Learned Potential (MLP) for Aluminum Using n2p2 Methodology in MedeA MLPG
University of Kazan Develops Highly Accurate Machine-Learned Potential (MLP) for Aluminum Using n2p2 Methodology in MedeA MLPG
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Katherine Hollingsworth
Jun 18, 20241 min read
Materials Design Scientists, Michele Kotiuga and Volker Eyert invited as working-group members of the Psi-k Network
Materials Design Scientists, Michele Kotiuga and Volker Eyert invited as working-group members of the Psik Network
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Katherine Hollingsworth
May 24, 20245 min read
MedeA Software Release MedeA 3.9 -- Materials Acceleration!
Accelerating Materials Innovation: Connecting Quantum Simulations, Machine Learning, and Mesoscale Modeling to Speed Up Materials Research
342 views0 comments
Katherine Hollingsworth
May 8, 20242 min read
Webinar: From the Femtoscale to the Mesoscale and Back: An Integrated Multiscale Approach
Webinar: From the Femtoscale to the Mesoscale and Back: An Integrated Multiscale Approach #engineering #compchem
127 views0 comments
Katherine Hollingsworth
Apr 25, 20242 min read
QuesTek and Materials Design, Inc. Announce Collaboration Partnership
The partnership will connect MedeA Environment outputs to ICMD® models to provide common clients with the most accurate predictive and presc
221 views0 comments
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