Science & Environment

Electron density check offers better starting point for chemistry's most difficult metal molecules

Source: Phys.org - latest science and technology news stories · Published

Electron density check offers better starting point for chemistry's most difficult metal molecules
Source: Phys.org - latest science and technology news stories

New materials and catalysts have the potential to transform everything from food production and medicine to batteries and stainless steel. Computer simulations help scientists narrow down promising candidates before testing them in a lab, but those simulations can be unreliable,

New materials and catalysts have the potential to transform everything from food production and medicine to batteries and stainless steel. Computer simulations help scientists narrow down promising candidates before testing them in a lab, but those simulations can be unreliable, especially for molecules that contain multiple metals.

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