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lgoerigk
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New article on fast DFT-D4 variants of leading DFT methods
Congrats to Asim Najibi on his newest paper in the Journal of Computational Chemistry. The paper presents DFT-D4 variants of the leading (ω)B97M/X class of functionals …
goerigk.chemistry.unimelb.edu.au/2020/09/02/new-article-on-fast-dft-d4-variants-of-leading-dft-methods
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New article on time-dependent double hybrid DFT
Congratulations to Marcos who published his latest contribution to the field of time-dependent range-separated double hybrids for excitation energies in a special issue on 65 Years …
goerigk.chemistry.unimelb.edu.au/2020/08/13/new-article-on-time-dependent-double-hybrid-dft
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Front cover in PCCP
Recently, we shared the news of an article by Dale Lonsdale that had been published in PCCP’s inaugural “Emerging Investigators” and the “2020 Hot Article” Themed …
goerigk.chemistry.unimelb.edu.au/2020/07/25/front-cover-in-pccp
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Lars Goerigk appointed to inaugural Chemical Reviews Early Career Advisory Board
Dr Lars Goerigk has joined the inaugural Early Career Advisory Board of Chemical Reviews as one of ten international early and mid-career researchers. The list of …
goerigk.chemistry.unimelb.edu.au/2020/07/16/lars-goerigk-appointed-to-inaugural-chemical-reviews-early-career-advisory-board
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New account takes you to the TD-DFT zoo
As a follow up to last year’s popular trip to the ground-state DFT zoo, we now take non-expert users on a trip to the TD-DFT zoo …
goerigk.chemistry.unimelb.edu.au/2020/06/30/new-account-takes-you-to-the-td-dft-zoo
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New article on semi-conducting mixed-valent coordination polymers
We are glad to have been involved in a collaboration on semi-conducting mixed-valent coordination polymers led by the Abrahams group at the School of Chemistry with …
goerigk.chemistry.unimelb.edu.au/2020/06/24/new-article-on-semi-conducting-mixed-valent-coordination-polymers
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Article on the self-interaction error now part of PCCP’s 2020 Hot Article Themed Collection
Our recent article on the one-electron self-interaction error that got published as part of PCCP’s inaugural Emerging Investigators Themed Collection, has been included to the journal’s …
goerigk.chemistry.unimelb.edu.au/2020/06/11/article-of-the-self-interaction-error-now-part-of-pccps-2020-hot-article-themed-collection
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New article in PCCP and recognition as an Emerging Investigator
Congratulations to Dale on his first paper. The article published in Physical Chemistry Chemical Physics (PCCP) deals with a yet-to-be-solved problem in Density Functional Theory (DFT), …
goerigk.chemistry.unimelb.edu.au/2020/05/05/new-article-in-pccp-and-recognition-as-an-emerging-investigator
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Nisha has been featured in Pursuit
Read Nisha Mehta’s inspiring story in the University of Melbourne’s newspaper “Pursuit”: https://pursuit.unimelb.edu.au/articles/my-eyesight-is-weak-but-my-vision-is-strong
goerigk.chemistry.unimelb.edu.au/2020/04/23/nisha-has-been-featured-in-pursuit
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Cover feature
Our recently published joint article on redox-active coordination polymers has been chosen as the cover feature in Eur. J. Inorg. Chem. The link to the article …
goerigk.chemistry.unimelb.edu.au/2020/04/16/cover-feature
Number of posts found: 142