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Molecular dynamics simulation of ion mobility in gases

A force field molecular dynamics method is developed to directly simulate ion drift in buffer gases driven by an electric field. The ion mobility and collision cross sections (CCSs) with relevance to ion mobility spectrometry can be obtained from the simulated drift velocity in high-density buffer g...

Deskribapen osoa

Gorde:
Xehetasun bibliografikoak
Argitaratua izan da:J Chem Phys
Egile Nagusiak: Lai, Rui, Dodds, Eric D., Li, Hui
Formatua: Artigo
Hizkuntza:Inglês
Argitaratua: AIP Publishing LLC 2018
Gaiak:
Sarrera elektronikoa:https://ncbi.nlm.nih.gov/pmc/articles/PMC5812742/
https://ncbi.nlm.nih.gov/pubmed/29448783
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1063/1.4998955
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