机译:DFT研究2、3、7、8-四氯二苯并-对-二恶英在原始和掺杂的黑色磷上的吸附行为
Southwest Univ Sci & Technol, Sch Mat Sci & Engn, Minist Educ, Engn Res Ctr Biomass Mat, Mianyang 621010, Sichuan, Peoples R China|East China Univ Sci & Technol, Key Lab Ultrafine Mat, Minist Educ, Shanghai 200237, Peoples R China;
Southwest Univ Sci & Technol, Sch Mat Sci & Engn, Minist Educ, Engn Res Ctr Biomass Mat, Mianyang 621010, Sichuan, Peoples R China;
Southwest Univ Sci & Technol, Sch Comp Sci & Engn, Mianyang 621010, Sichuan, Peoples R China;
Southwest Univ Sci & Technol, Sch Mat Sci & Engn, Minist Educ, Engn Res Ctr Biomass Mat, Mianyang 621010, Sichuan, Peoples R China;
Southwest Univ Sci & Technol, Sch Mat Sci & Engn, Minist Educ, Engn Res Ctr Biomass Mat, Mianyang 621010, Sichuan, Peoples R China;
Southwest Univ Sci & Technol, Sch Mat Sci & Engn, Minist Educ, Engn Res Ctr Biomass Mat, Mianyang 621010, Sichuan, Peoples R China;
East China Univ Sci & Technol, Key Lab Ultrafine Mat, Minist Educ, Shanghai 200237, Peoples R China;
Flinders Univ S Australia, Ctr NanoScale Sci & Technol, Adelaide, SA 5042, Australia|Flinders Univ S Australia, Sch Comp Sci Engn & Math, Adelaide, SA 5042, Australia;
Phosphorene; Doping; Density functional theory; TCDD;
机译:二氧化碳对原始和掺杂磷的吸附行为:分散校正DFT研究
机译:D在原始和掺杂的B_(12)P_(12)纳米笼中对CO的吸附行为
机译:菌株诱导PFOS对原始和缺陷磷烯的吸附变异:DFT研究
机译:黑色磷烯和掺杂磷烯的热性能(C,N&O):DFT研究
机译:原始和掺杂钛的铝酸钠在储氢应用中的计算研究。
机译:3d过渡金属掺杂的黑色和蓝色磷光体中的稀磁半导体和半金属行为:第一性原理研究
机译:原始和掺杂黑色磷烯的2,3,7,8-四氯二苯并二聚酮苷的吸附行为:DFT研究