Molecular dynamics simulation on the interaction mechanism between polymer inhibitors and calcium phosphate

Journal of Chemical Sciences

Volumn 126, Issue 3, 2014, Pages 649-658

  Zeng, Jian Ping ^a,b   Qian, Xiao Rong ^a   Wang, Feng He ^c   Shao, Jing Ling ^a   Bai, Yun Shan ^a  

^a YANCHENG INSTITUTE OF TECHNOLOGY   (China)

^b UNIVERSITY OF SCIENCE AND TECHNOLOGY OF CHINA   (China)

^c NANJING NORMAL UNIVERSITY   (China)

Author keywords

binding energy; hydroxyapatite; molecular dynamics; pair correlation function; Polymer inhibitor

Indexed keywords

BINDING ENERGY; CALCIUM; CALCIUM PHOSPHATE; CORROSION INHIBITORS; HYDROXYAPATITE; MOLECULAR DYNAMICS; MOLECULES; ORGANIC ACIDS; SOLVENTS;

DEFORMATION ENERGY; INTERACTION MECHANISMS; MICROSCOPIC INTERACTION; MOLECULAR DYNAMICS SIMULATIONS; PAIR CORRELATION FUNCTIONS; POLYEPOXYSUCCINIC ACID (PESA); POLYMER INHIBITOR; SCALE INHIBITION MECHANISMS;

POLYMERS;

EID: 84902438307     PISSN: 09743626     EISSN: 09737103     Source Type: Journal    
DOI: 10.1007/s12039-014-0618-8     Document Type: Article

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