Backbone flexibility of extended metal atom chains. Ab initio molecular dynamics for Cr3(dpa)4X2 (X = NCS, CN, NO3) in gas and crystalline phases
Keyword(s):
Computational study on the flexibility of chromium extended metal atom chains by ab initio molecular dynamics.
Keyword(s):
2015 ◽
Vol 17
(25)
◽
pp. 16359-16366
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2019 ◽