Physicists Have Just Found a Brand New Atomic Nucleus : ScienceAlert
https://www.sciencealert.com/physicists-have-just-found-a-brand-new-atomic-nucleus
https://www.sciencealert.com/physicists-have-just-found-a-brand-new-atomic-nucleus
ScienceAlert
Physicists Have Just Found a Brand New Atomic Nucleus
Surprise!
Scientists Predict Never-Before-Seen Crystal Structures With Unexpected Chemistry : ScienceAlert
https://www.sciencealert.com/scientists-predict-never-before-seen-crystal-structures-with-unexpected-chemistry
https://www.sciencealert.com/scientists-predict-never-before-seen-crystal-structures-with-unexpected-chemistry
ScienceAlert
Scientists Predict Never-Before-Seen Crystal Structures With Unexpected Chemistry
This is completely new.
A New Ultrafast Camera Captures Molecular Dynamics In Cells - Asian Scientist Magazine
https://www.asianscientist.com/2023/07/in-the-lab/a-new-ultrafast-camera-captures-molecular-dynamics-in-cells/
https://www.asianscientist.com/2023/07/in-the-lab/a-new-ultrafast-camera-captures-molecular-dynamics-in-cells/
Perplexity AI - a co-pilot engine powered by GPT 3.5 (free) and GPT 4 (paid)
https://www.perplexity.ai/
https://www.perplexity.ai/
Perplexity AI
Perplexity is a free AI-powered answer engine that provides accurate, trusted, and real-time answers to any question.
GAMESS - June 30, 2023 R1 Public Release
A new public release of GAMESS is now available on the distribution server: https://www.msg.chem.iastate.edu/GAMESS/download.html
Release notes are now distributed with the source: $GMS_DIR/RELEASE.md (it is a markdown file - view with a markdown viewer or any text editor).
THE LIST OF NEW FEATURES IS HUGE!
Please use our public issue tracker to report any problems: https://github.com/gms-bbg/gamess-issues
A new public release of GAMESS is now available on the distribution server: https://www.msg.chem.iastate.edu/GAMESS/download.html
Release notes are now distributed with the source: $GMS_DIR/RELEASE.md (it is a markdown file - view with a markdown viewer or any text editor).
THE LIST OF NEW FEATURES IS HUGE!
Please use our public issue tracker to report any problems: https://github.com/gms-bbg/gamess-issues
GitHub
GitHub - gms-bbg/gamess-issues: GAMESS issue tracking
GAMESS issue tracking. Contribute to gms-bbg/gamess-issues development by creating an account on GitHub.
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Machine learning enables accurate electronic structure calculations at large scales for material modeling
https://phys.org/news/2023-07-machine-enables-accurate-electronic-large.html
https://phys.org/news/2023-07-machine-enables-accurate-electronic-large.html
phys.org
Machine learning enables accurate electronic structure calculations at large scales for material modeling
The arrangement of electrons in matter, known as the electronic structure, plays a crucial role in fundamental but also applied research, such as drug design and energy storage. However, the lack of a ...
New hydrodynamic theory helps to understand the correlation of ions
https://phys.org/news/2023-07-hydrodynamic-theory-ions.html
https://phys.org/news/2023-07-hydrodynamic-theory-ions.html
phys.org
New hydrodynamic theory helps to understand the correlation of ions
In their theoretical work, Dr. Diddo Diddens from Helmholtz Institute Münster of Forschungszentrum Jülich and Prof. Andreas Heuer from the Helmholtz Institute Münster and the Institute of Physical ...
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The 'Most Precise Measurement Yet' of an Electron's Dipole Moment Has Just Been Taken : ScienceAlert
https://www.sciencealert.com/the-most-precise-measurement-yet-of-an-electrons-dipole-moment-has-just-been-taken
https://www.sciencealert.com/the-most-precise-measurement-yet-of-an-electrons-dipole-moment-has-just-been-taken
ScienceAlert
The 'Most Precise Measurement Yet' of an Electron's Dipole Moment Has Just Been Taken
It could solve one of the Universe's biggest mysteries.
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A New Experiment Casts Doubt on the Leading Theory of the Nucleus - Nautilus
https://nautil.us/a-new-experiment-casts-doubt-on-the-leading-theory-of-the-nucleus-352026/
https://nautil.us/a-new-experiment-casts-doubt-on-the-leading-theory-of-the-nucleus-352026/
Nautilus
A New Experiment Casts Doubt on the Leading Theory of the Nucleus
By measuring inflated helium nuclei, physicists have challenged our best understanding of the force that binds protons and neutrons.
MIT Researchers Have Developed a Unified Framework that Uses Machine Learning to Simultaneously Predict Molecular Properties and Generate New Molecules Using Only a Small Amount of Data for Training - MarkTechPost
https://www.marktechpost.com/2023/07/11/mit-researchers-have-developed-a-unified-framework-that-uses-machine-learning-to-simultaneously-predict-molecular-properties-and-generate-new-molecules-using-only-a-small-amount-of-data-for-training/
https://www.marktechpost.com/2023/07/11/mit-researchers-have-developed-a-unified-framework-that-uses-machine-learning-to-simultaneously-predict-molecular-properties-and-generate-new-molecules-using-only-a-small-amount-of-data-for-training/
MarkTechPost
MIT Researchers Have Developed a Unified Framework that Uses Machine Learning to Simultaneously Predict Molecular Properties and…
To have a discovery via a Machine Learning algorithm, we need to have a large dataset of training data. There was a problem in predicting the molecular properties and generating new molecules. This can be solved via Machine Learning and Deep Learning approaches.…
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Now the excellent semi-empirical method GFN2-xTB has spin-polarized capabilities. Truly exciting news!
Read the paper: https://doi.org/10.1002/jcc.27185
Read the paper: https://doi.org/10.1002/jcc.27185
Wiley Online Library
High‐throughput screening of spin states for transition metal complexes with spin‐polarized extended tight‐binding methods
The semiempirical GFNn-xTB methods are extended with a spin-dependent energy term (spin-polarization), enabling the efficient screening of spin states for transition metal complexes. The performance ...
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The central role of density functional theory in the AI age | Science
https://www.science.org/doi/10.1126/science.abn3445
https://www.science.org/doi/10.1126/science.abn3445
Science
The central role of density functional theory in the AI age
Density functional theory (DFT) plays a pivotal role in chemical and materials science because of its relatively high predictive power, applicability, versatility, and computational efficiency. We review recent progress in machine learning (ML) model ...
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Researchers develop open-source software to speed up quantum research
https://phys.org/news/2023-06-open-source-software-quantum.html
https://phys.org/news/2023-06-open-source-software-quantum.html
phys.org
Researchers develop open-source software to speed up quantum research
Quantum technology is expected to fundamentally change many key areas of society. Researchers are convinced that there are many more useful quantum properties and applications to explore than those we ...
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