Theoretical study on the electrical and mechanical properties of MXene multilayer structures through strain regulation
- 17 September 2020
- journal article
- research article
- Published by Elsevier BV in Chemical Physics Letters
- Vol. 760, 137997
- https://doi.org/10.1016/j.cplett.2020.137997
Abstract
No abstract availableKeywords
Funding Information
- National Key Research and Development Program of China (2016YFB0700100, 2019YFB1901001)
- Zhejiang Province Key Research and Development Program (2019C01060)
- National Natural Science Foundation of China (21875271, 21707147, 11604346, 21671195, 51872302)
- K.C.Wong Education Foundation (rczx0800)
- Foundation of State Key Laboratory of Coal Conversion (J18-19-301)
This publication has 63 references indexed in Scilit:
- Two-Dimensional Transition Metal CarbidesACS Nano, 2012
- Two‐Dimensional Nanocrystals Produced by Exfoliation of Ti3AlC2Advanced Materials, 2011
- Elastic and Mechanical Properties of the MAX PhasesAnnual Review of Materials Research, 2011
- Electronic properties of F/Zr co-doped anatase TiO2 photocatalysts from GGA+U calculationsChemical Physics Letters, 2010
- A consistent and accurate ab initio parametrization of density functional dispersion correction (DFT-D) for the 94 elements H-PuThe Journal of Chemical Physics, 2010
- The M+1AX phases: Materials science and thin-film processingThin Solid Films, 2009
- The invention of the transistorProceedings of the IEEE, 1998
- Generalized Gradient Approximation Made SimplePhysical Review Letters, 1996
- Efficient iterative schemes forab initiototal-energy calculations using a plane-wave basis setPhysical Review B, 1996
- Conjugate gradient minimization of the energy functional: A new method for electronic structure calculationPhysical Review B, 1989