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Frank Neese

Showing results (551-560 of 560) with videos related to

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Nature Communications|July 4, 2018
Spin-phonon couplings in transition metal complexes with slow magnetic relaxationDuncan H Moseley, Shelby E Stavretis, Komalavalli Thirunavukkuarasu, et al.
Inorganic Chemistry|October 29, 2013
Experimental and computational X-ray emission spectroscopy as a direct probe of protonation states in oxo-bridged Mn(IV) dimers relevant to redox-active metalloproteinsBenedikt Lassalle-Kaiser, Thaddeus T Boron, Vera Krewald, et al.
Journal of the American Chemical Society|October 12, 2016
A Structurally Characterized Nonheme Cobalt-Hydroperoxo Complex Derived from Its Superoxo Intermediate via Hydrogen Atom AbstractionChun-Chieh Wang, Hao-Ching Chang, Yei-Chen Lai, et al.
Inorganic Chemistry|October 20, 2022
Comprehensive Studies of Magnetic Transitions and Spin-Phonon Couplings in the Tetrahedral Cobalt Complex Co(AsPh<sub>3</sub>)<sub>2</sub>I<sub>2</sub>Duncan H Moseley, Zhiming Liu, Alexandria N Bone, et al.
The Journal of Chemical Physics|January 8, 2018
The furan microsolvation blind challenge for quantum chemical methods: First stepsHannes C Gottschalk, Anja Poblotzki, Martin A Suhm, et al.
The Journal of Chemical Physics|May 3, 2020
The first microsolvation step for furans: New experiments and benchmarking strategiesHannes C Gottschalk, Anja Poblotzki, Mariyam Fatima, et al.
Faraday Discussions|October 8, 2024
Novel perturbative and variational methods for stronger correlations: general discussionVibin Abraham, Kemal Atalar, Kenneth O Berard, et al.
Science (New York, N.Y.)|November 2, 2023
Reactive high-spin iron(IV)-oxo sites through dioxygen activation in a metal-organic frameworkKaipeng Hou, Jonas Börgel, Henry Z H Jiang, et al.
Faraday Discussions|October 15, 2024
Stochastic and low-scaling techniques: general discussionAli Alavi, Marcus Allen, Kemal Atalar, et al.
Physical Chemistry Chemical Physics : PCCP|October 21, 2022
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials scienceAndrew M Teale, Trygve Helgaker, Andreas Savin, et al.
Pageof 56

Showing results (551-560 of 560) with videos related to

Sort By:
Pageof 56
You have reached the last page of results.This site can display upto 560 results.
Nature Communications|July 4, 2018
Spin-phonon couplings in transition metal complexes with slow magnetic relaxationDuncan H Moseley, Shelby E Stavretis, Komalavalli Thirunavukkuarasu, et al.
Inorganic Chemistry|October 29, 2013
Experimental and computational X-ray emission spectroscopy as a direct probe of protonation states in oxo-bridged Mn(IV) dimers relevant to redox-active metalloproteinsBenedikt Lassalle-Kaiser, Thaddeus T Boron, Vera Krewald, et al.
Journal of the American Chemical Society|October 12, 2016
A Structurally Characterized Nonheme Cobalt-Hydroperoxo Complex Derived from Its Superoxo Intermediate via Hydrogen Atom AbstractionChun-Chieh Wang, Hao-Ching Chang, Yei-Chen Lai, et al.
Inorganic Chemistry|October 20, 2022
Comprehensive Studies of Magnetic Transitions and Spin-Phonon Couplings in the Tetrahedral Cobalt Complex Co(AsPh<sub>3</sub>)<sub>2</sub>I<sub>2</sub>Duncan H Moseley, Zhiming Liu, Alexandria N Bone, et al.
The Journal of Chemical Physics|January 8, 2018
The furan microsolvation blind challenge for quantum chemical methods: First stepsHannes C Gottschalk, Anja Poblotzki, Martin A Suhm, et al.
The Journal of Chemical Physics|May 3, 2020
The first microsolvation step for furans: New experiments and benchmarking strategiesHannes C Gottschalk, Anja Poblotzki, Mariyam Fatima, et al.
Faraday Discussions|October 8, 2024
Novel perturbative and variational methods for stronger correlations: general discussionVibin Abraham, Kemal Atalar, Kenneth O Berard, et al.
Science (New York, N.Y.)|November 2, 2023
Reactive high-spin iron(IV)-oxo sites through dioxygen activation in a metal-organic frameworkKaipeng Hou, Jonas Börgel, Henry Z H Jiang, et al.
Faraday Discussions|October 15, 2024
Stochastic and low-scaling techniques: general discussionAli Alavi, Marcus Allen, Kemal Atalar, et al.
Physical Chemistry Chemical Physics : PCCP|October 21, 2022
DFT exchange: sharing perspectives on the workhorse of quantum chemistry and materials scienceAndrew M Teale, Trygve Helgaker, Andreas Savin, et al.
Pageof 56