Quantitative structure-property relationship study of cathode volume changes in lithium ion batteries using ab-initio and partial least squares analysis
In this paper, we report a method through the combination of ab-initio calculations and partial least squares (PLS) analysis to develop the Quantitative Structure –Activity Relationship (QSAR) formulations of cathode volume changes in lithium ion batteries. The PLS analysis is based on ab-initio cal...
| Main Authors: | , , , |
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| Format: | Article |
| Language: | English |
| Published: |
Elsevier
2017-09-01
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| Series: | Journal of Materiomics |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2352847816301113 |