Computational and Quantum Chemistry pinned «Hi! The year is coming to an end, and we’d like to thank the almost 1400 members of this group. It is amazing to know that so many people could gather around a topic as challenging (and fun) as computational chemistry. We do hope to have shared valuable information…»
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Machine learning the Hohenberg-Kohn map for molecular excited states
https://www.nature.com/articles/s41467-022-34436-w
Machine learning the Hohenberg-Kohn map for molecular excited states
https://www.nature.com/articles/s41467-022-34436-w
Nature
Machine learning the Hohenberg-Kohn map for molecular excited states
Nature Communications - Density functional theory provides a formal map from the electron density to all observables of interest of a many-body system; however, maps for electronic excited states...
PhD positions at University of South Carolina
Two PhD positions in computational materials science for quantum applications are available in the group of Dr. Sai Mu in the Department of Physics and Astronomy at University of South Carolina. The positions are available in Fall 2023. Research is focused on the first-principles calculations to understand the fundamental properties (electronic, magnetic, vibrational, transport properties) of advanced quantum materials towards applications in quantum information, energy conversion and information processing.
Desired qualifications:
Highly motivated students who have research interests and background in condensed matter physics and computational materials science are encouraged to apply. Candidate should have good communication skills and be able to work in a team. Any research experience with first-principles calculations is highly desirable.
How to apply:
Information about the PhD program in the department of Physics and Astronomy at University of South Carolina and how to apply can be found on the following website: https://sc.edu/study/colleges_schools/graduate_school/apply/degree_programs-application-requirements/physics-phd/index.php. The deadline of the application is flexible. If interested, please submit the application and email Dr. Mu (mus@mailbox.sc.edu) with your CV and a brief summary of your research experience and interests.
Two PhD positions in computational materials science for quantum applications are available in the group of Dr. Sai Mu in the Department of Physics and Astronomy at University of South Carolina. The positions are available in Fall 2023. Research is focused on the first-principles calculations to understand the fundamental properties (electronic, magnetic, vibrational, transport properties) of advanced quantum materials towards applications in quantum information, energy conversion and information processing.
Desired qualifications:
Highly motivated students who have research interests and background in condensed matter physics and computational materials science are encouraged to apply. Candidate should have good communication skills and be able to work in a team. Any research experience with first-principles calculations is highly desirable.
How to apply:
Information about the PhD program in the department of Physics and Astronomy at University of South Carolina and how to apply can be found on the following website: https://sc.edu/study/colleges_schools/graduate_school/apply/degree_programs-application-requirements/physics-phd/index.php. The deadline of the application is flexible. If interested, please submit the application and email Dr. Mu (mus@mailbox.sc.edu) with your CV and a brief summary of your research experience and interests.
Electrochemistry converts carbon to useful molecules
https://phys.org/news/2023-01-electrochemistry-carbon-molecules.html
https://phys.org/news/2023-01-electrochemistry-carbon-molecules.html
phys.org
Electrochemistry converts carbon to useful molecules
A chemistry collaboration has led to a creative way to put carbon dioxide to good—and even healthy—use: by incorporating it, via electrosynthesis, into a series of organic molecules that are vital ...
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Single-Figure Presentation (SFP) submission for the next Virtual Winter School on Computational Chemistry is now open! The deadline is 30.01.2023. We are looking forward to seeing your work! #compchem #CompChemVirtual
https://winterschool.cc/
https://winterschool.cc/
winterschool.cc
Virtual Winter School on Computational Chemistry - Home
Online congress discussing state of the art computational chemistry
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'A perfect little system': Physicists isolate a pair of atoms to observe p-wave interaction strength for the first time
https://phys.org/news/2023-01-physicists-isolate-pair-atoms-p-wave.html
https://phys.org/news/2023-01-physicists-isolate-pair-atoms-p-wave.html
phys.org
'A perfect little system': Physicists isolate a pair of atoms to observe p-wave interaction strength for the first time
"Suppose you knew everything there was to know about a water molecule—the chemical formula, the bond angle, etc.," says Joseph Thywissen, a professor in the Department of Physics and a member of the ...
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What are you working with?
Anonymous Poll
28%
Metal-organic
42%
Organic
12%
Bulk inorganic
22%
Solid state with pbc
29%
Other
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Watch "Ch 7: How are observables operators? | Maths of Quantum Mechanics" on YouTube
https://youtu.be/ANLRQ7X6h5A
https://youtu.be/ANLRQ7X6h5A
YouTube
Ch 7: How are observables operators? | Maths of Quantum Mechanics
Hello!
This is the seventh chapter in my series "Maths of Quantum Mechanics." In this episode, we'll go over how we represent physical quantities as operators in quantum mechanics. We'll also use our physicist's intuition to derive that observables must…
This is the seventh chapter in my series "Maths of Quantum Mechanics." In this episode, we'll go over how we represent physical quantities as operators in quantum mechanics. We'll also use our physicist's intuition to derive that observables must…
New Research Reveals the Biochemical “Rings of Power”
https://scitechdaily.com/new-research-reveals-the-biochemical-rings-of-power/
https://scitechdaily.com/new-research-reveals-the-biochemical-rings-of-power/
SciTechDaily
New Research Reveals the Biochemical “Rings of Power”
The process of genome mining reveals a common category of naturally occurring compounds that have the potential as viable drug candidates. Researchers at the Max Planck Institute for Terrestrial Microbiology have discovered the biosynthesis of a rare compound…
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Researcher posits that electrons do spin, thanks to their fields
https://phys.org/news/2023-01-posits-electrons-fields.html
https://phys.org/news/2023-01-posits-electrons-fields.html
phys.org
Researcher posits that electrons do spin, thanks to their fields
Deep inside all matter in the universe, electrons are buzzing around and behaving as if they are twirling around on their axes like spinning tops. These "spinning" electrons are fundamental to quantum ...
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