8 research outputs found
Looking for Design in Materials Design
Full text linkDespite great advances in computation, materials design is still science
fiction. The construction of structure-property relations on the quantum scale
will turn computational empiricism into true design.Comment: 3 pages, 1 figur
The formulation of optimal mixtures with generalized disjunctive programming: A solvent design case study
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Design of Solvent Mixtures for Selective Extraction by Quantifying Thermodynamic and Sustainability Aspects
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