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Ab Initio Modelling of Lanthanide-Based Molecular Magnets: Where to from Here?

Sourav Dey, Tanu Sharma, Arup Sarkar, Gopalan Rajaraman

2023Challenges and advances in computational chemistry and physics10 citationsDOI

Topics & Concepts

LanthanideAb initioMoleculeAb initio quantum chemistry methodsRelaxation (psychology)Chemical physicsDysprosiumMaterials scienceComputational chemistryChemistryCrystallographyIonInorganic chemistryOrganic chemistryPsychologySocial psychologyMagnetism in coordination complexesLanthanide and Transition Metal ComplexesElectron Spin Resonance Studies
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