MONOMER UNITS DIFFERENTIATED SOLVATION IN AN ACRYLIC ACID CROSSLINKED POLYELECTROLYTE. A COMBINED HF/MD STUDY&
A suitable model for molecular dynamics simulation studies of an acrylic acid (AA) polyelectrolyte gel considering explicit water molecules is presented. It consists of a molecule of crosslinker bound to four AA strands completely ionized. Radial distribution functions and nonbonding energy results...
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| Autores principales: | , , |
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| Lenguaje: | English |
| Publicado: |
Sociedad Chilena de Química
2001
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| Materias: | |
| Acceso en línea: | http://www.scielo.cl/scielo.php?script=sci_arttext&pid=S0366-16442001000100014 |
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