作者: L. G. Zhou , Hanchen Huang
DOI: 10.1063/1.1682698
关键词: Ab initio quantum chemistry methods 、 Condensed matter physics 、 Saturation (chemistry) 、 Young's modulus 、 Classical mechanics 、 Materials science 、 Modulus 、 Stiffening 、 Elastic modulus 、 Electron 、 Softening
摘要: This letter addresses the issue of surface softening versus stiffening during elastic deformation. Using a combination of molecular statics and ab initio calculations, we show …