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News

A cloud image that also includes molecules and test tubes

January 14, 2025: Research Highlight

Porting Scalable Computational Chemistry to Cloud Computing

Electronic structure codes in a cloud environment can enable efficient computational chemistry simulations.

 

 

A cloud image that also includes molecules and test tubes

October 21, 2024: News Release

Cloud Computing Captures Chemistry Code

An innovative all-of-computing approach offers the potential for sustainable cloud computing applications to address urgent energy needs.


 

Digital icons on a cyber-themed background, representing computational chemistry workflow

April 3, 2024: Feature

Computational Chemistry Needs to be Sustainable, Too

Chemists prepare to meet the computational challenges of the future in a coordinated effort.


 

Transferring Exascale Computational Chemistry to Cloud Computing Environment and Emerging Hardware Technologies (TEC4)

February 15, 2024: Feature

TEC4 researchers interviewed for Nature Methods technology feature

Karl Mueller, Karol Kowalski, and Christina Lomasney work with a team of PNNL and partner institution colleagues to give the computational chemistry community access to high-performance computing resources as part of a two-year collaborative project initiated by PNNL.   
 

Karol Kowalski

October 4, 2023: Podcast

A National Lab Wants to Make Complex Chemistry Problems a Little More Solvable

Pacific Northwest National Laboratory (PNNL) is collaborating with Microsoft Corp. and Micron Technology to make computational chemistry broadly available to applied researchers and industrial users. For more, Federal Drive with Tom Temin‘s Eric White spoke with the PNNL scientist leading the effort, Karol Kowalski.

 

Artist's render of computational chemistry, showing orbs connected to each other

September 20, 2023: News Release

PNNL Collaborates with Microsoft, Micron to Bring Computational Chemistry to the Masses

DOE-funded program brings cloud, memory innovations together to accelerate technology transfer.

 

 

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