主要成就
{"yanjiu_chengguo":"","xiangmu":"","lunzhu":"1、StudyofElectronicStructure,ThermalConductivity,ElasticandOpticalPropertiesofα,β,γ-Graphyne，Materials11(2018)188；doi:10.3390/ma110201882、Fe-X(X=B,N)binarycompounds:First-principlescalculationsofelectronicstructures,theoretichardnessandmagneticproperties，JournalofMagnetismandMagneticMaterials451(2018)761-7693、DeformationModesandAnisotropyofAnti-PerovskiteTi3AN(A=Al,InandTl)fromFirst-PrincipleCalculations，Materials10(2017)362;doi:10.3390/ma100403624、Elasticity,hardness,andthermalpropertiesofZrBn(n=1,2,12),CeramicsInternational42(2016)6624–66315、Electronicstructures,elasticandopticalpropertiesofM2O5(M=V,Nb,Ta),SciChinaMater59(2016)2656、超硬材料bc-BnCN(n=1,2,4)的弹性、硬度及其各向异性,中国科学:物理学力学天文学46(6)(2015)0646017、HfO2多型体的弹性、慢度和热导率及其各向异性研究，中国科学:物理学力学天文学45(5)(2015)0546028、Mechanicalproperties,minimumthermalconductivity,andanisotropyinbc-structuresuperhardmaterials，ComputationalMaterialsScience102(2015)327–3379、Elasticproperties,hardness,andanisotropyinbaddeleyiteIVTMO2(M=Ti,Zr,Hf)，SciChinaMater58(2015)893–90510、Anisotropiesofelasticityandthermalconductivityinsomenovelsuperhardmaterials，ComputationalMaterialsScience88(2014)103–109","zhuanli":""}
