EFGShield Download Form

Citation: S. Adiga, D. Aebi, and D. L. Bryce, EFGShield: A Program for Parsing and Summarizing the Results of Electric Field Gradient and Nuclear Magnetic Shielding Tensor Calculations, Can. J. Chem., 85, 496-505 (2007).

To access a link to download the latest version of EFGShield, please provide the following information:

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What do you anticipate being the most useful aspect of EFGShield for you? (optional, check all that apply)

Extracting Euler angles
Conversion of EFG to give quadrupolar coupling constant
Tensor orientation visualization
Obtaining EFG and shielding eigenvalues and eigenvectors
Speed of analysis of Gaussian output
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In what areas of your research do you foresee using EFGShield? (optional, check all that apply)

Small molecule NMR
Fundamental computational NMR studies
Inorganic materials
Organic compounds
Biochemical systems
Catalysis
Fundamental studies of quadrupolar nuclei
Studies of spin-1/2 nuclei
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