Simulation of the structure and mechanics of crystalline 4,4′-diphenylmethane diisocyanate (MDI) with n -butanediol (BDO) as chain extender
We report molecular simulation, at the atomistic level, of crystalline 4,4′-diphenylmethane diisocyanate (MDI) with n-butanediol (BDO) as chain extender, henceforth denoted as MDI/BDO, which is one of the most important components of thermoplastic polyurethanes. This work studies the structure and p...
Main Authors: | in ‘t Veld, Pieter J., Lempesis, Nikolaos, Rutledge, Gregory C |
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Other Authors: | Massachusetts Institute of Technology. Department of Chemical Engineering |
Format: | Article |
Language: | en_US |
Published: |
Elsevier
2018
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Online Access: | http://hdl.handle.net/1721.1/119824 https://orcid.org/0000-0002-4104-9666 https://orcid.org/0000-0001-8137-1732 |
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