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Analysis of the Greenness and Whiteness of Selected Quantum Mechanical Methods of Nmr Shielding Constant Calculations

https://doi.org/10.2139/ssrn.4811233
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Outgoing claims: the papers this work cites, builds on, or argues with.

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Systematic Study of Locally Dense Basis Sets for NMR Shielding Constants
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Benchmarking Hydrogen and Carbon NMR Chemical Shifts at HF, DFT, and MP2 Levels
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Regression Formulas for Density Functional Theory Calculated 1H and 13C NMR Chemical Shifts in Toluene-d8
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The 13 Principles of Green Chemistry and Engineering for a Greener Africa
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Fundamentals of green chemistry: efficiency in reaction design
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What does it mean that “something is green”? The fundamentals of a Unified Greenness Theory
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Power Measurements of Hartree-Fock Algorithms Using Different Storage Devices
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Green Chemistry: Science and Politics of Change
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DELTA50: A Highly Accurate Database of Experimental 1H and 13C NMR Chemical Shifts Applied to DFT Benchmarking
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