Showing results (81-90 of 276) with videos related to

Sort By:
Pageof 28
Inorganic Chemistry|June 23, 2021
Record High Magnetic Anisotropy in Three-Coordinate Mn<sup>III</sup> and Cr<sup>II</sup> Complexes: A Theoretical PerspectiveArup Sarkar, Reshma Jose, Harshit Ghosh, et al.
Physical Chemistry Chemical Physics : PCCP|January 6, 2011
A periodic mixed gaussians-plane waves DFT study on simple thiols on Au(111): adsorbate species, surface reconstruction, and thiols functionalizationGopalan Rajaraman, Andrea Caneschi, Dante Gatteschi, et al.
Inorganic Chemistry|July 23, 2021
Mechanistic Insights into the Oxygen Atom Transfer Reactions by Nonheme Manganese Complex: A Computational Case Study on the Comparative Oxidative Ability of Manganese-Hydroperoxo vs High-Valent Mn<sup>IV</sup>═O and Mn<sup>IV</sup>-OH IntermediatesRavi Kumar, Bhawana Pandey, Akta Singh, et al.
Dalton Transactions (Cambridge, England : 2003)|September 27, 2013
Theoretical studies on concerted versus two steps hydrogen atom transfer reaction by non-heme Mn(IV/III)=O complexes: how important is the oxo ligand basicity in the C-H activation step?Madhavan Jaccob, Azaj Ansari, Bhawana Pandey, et al.
Chemical Communications (Cambridge, England)|May 14, 2016
An unprecedented zero field neodymium(iii) single-ion magnet based on a phosphonic diamideSandeep K Gupta, Thayalan Rajeshkumar, Gopalan Rajaraman, et al.
Chemistry (Weinheim an Der Bergstrasse, Germany)|September 12, 2019
A Design Criteria to Achieve Giant Ising-Type Anisotropy in Co<sup>II</sup> -Encapsulated MetallofullerenesMukesh Kumar Singh, Pratima Shukla, Munmun Khatua, et al.
Dalton Transactions (Cambridge, England : 2003)|August 30, 2017
Key role of higher order symmetry and electrostatic ligand field design in the magnetic relaxation of low-coordinate Er(iii) complexesSaurabh Kumar Singh, Bhawana Pandey, Gunasekaran Velmurugan, et al.
Chemical Communications (Cambridge, England)|October 31, 2014
Unprecedented magnetic relaxation via the fourth excited state in low-coordinate lanthanide single-ion magnets: a theoretical perspectiveSaurabh Kumar Singh, Tulika Gupta, Maheswaran Shanmugam, et al.
Dalton Transactions (Cambridge, England : 2003)|September 3, 2013
Enhancing the double exchange interaction in a mixed valence {V(III)-V(II)} pair: a theoretical perspectiveSoumen Ghosh, Saurabh Kumar Singh, Subrata Tewary, et al.
Dalton Transactions (Cambridge, England : 2003)|December 8, 2017
Is a strong axial crystal-field the only essential condition for a large magnetic anisotropy barrier? The case of non-Kramers Ho(iii) versus Tb(iii )Sandeep K Gupta, Thayalan Rajeshkumar, Gopalan Rajaraman, et al.
Pageof 28