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PELDOR
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2022-07-14
相关数据集
Half-Integer Spin Heptanuclear Single-Molecule Magnet with an Unusual Mn III 6 Mn II Exchange-Coupled Core
The synthesis, X-ray crystallography, magnetic properties, and high-field electron paramagnetic resonance (HFEPR) of a new heptanuclear manganese complex [Mn7(heamp)6](ClO4)2·4CH2Cl2·H2O (complex 2),
NIAID Data Ecosystem130
Calculations of the EPR g -tensor using unrestricted two- and four-component relativistic approaches within the HF and DFT frameworks
Approaches and programs for calculations of the EPR g -tensor in the framework of the two- and four-component methods are still very rare. There are three main reasons for this: the wider commun
DataCite Commons2020-09-04 更新70
Triple ring resonator
Dataset for the paper "Sample-accessible multi-resonance X-band EPR triple ring resonator"
B2FIND60
EPR linewidths and g-values of FeSI and FeSII from mAOX1.
aAOX wild-type from rabbit liver, values from [36]. bg-strain was included in the simulation with 0.01 for gz . cg-strain was included in the simulation with 0.04 for gx . Estimated error of g-values:
NIAID Data Ecosystem90
Calculations of the EPR g -tensor using unrestricted two- and four-component relativistic approaches within the HF and DFT frameworks
Approaches and programs for calculations of the EPR g-tensor in the framework of the two- and four-component methods are still very rare. There are three main reasons for this: the wider community's u
NIAID Data Ecosystem60
