来源:Frontiers in Physics , 2023
作者:Yang Li
关键词:DFPT calculation;phonon;...
使用许可:Unknown
来源:Frontiers in Cellular and Infection Microbiology , 2023
作者:Imren Bayıl;Amare Bitew Mekonnen;Mohammed Bourhia;等
关键词:molecular docking;DFT;...
使用许可:Unknown
3 Theoretical insights into the methane catalytic decomposition on graphene nanoribbons edges [期刊论文]
来源:Frontiers in Chemistry , 2023
作者:Glauco F. Bauerfeldt;Anthony J. R. Payne;Marco Sacchi;等
关键词:methane;DFT;...
使用许可:Unknown
来源:Frontiers in Chemistry , 2023
作者:Joydeep Chowdhury, Václav Ranc, Sougata Sarkar
关键词:SERS;plasmons;...
使用许可:Unknown
来源:Frontiers in Chemistry , 2023
作者:Oleksandr Loboda;Peter Strizhak;Ctirad Cervinka;等
关键词:DFT;GIPAW;...
使用许可:Unknown
来源:Frontiers in Environmental Science , 2023
作者:Anwar Ul-Hamid;Francisco Medina;Walid Nabgan;等
关键词:graphene oxide;CaO;...
使用许可:Unknown