1) full-potential linearized augmented plane wave
全势能线性缀加平面波
1.
The density functional theory on the level of generalized gradient approximation and full-potential linearized augmented plane wave,and the two-dimensional cubic fitting method have been used to calculate the geometrical and elastic property of LaNi3.
在全电子水平上,采用广义梯度近似密度泛函理论和全势能线性缀加平面波方法并结合二维立方拟合方法,对LaNi3。
2) FPLAPW
全势线性缀加平面波
1.
The equilibrium structure, electronic structure, and formation heat of Pu3M (PuM3) (M=Ga, In, Sn and Ge) compounds with AuCu3 structure have been calculated using full potential linear augmented plane wave (FPLAPW) method with generalized-gradient approximation (GGA) including spin-orbit coupling (SOC) and spin polarized (SP).
采用全势线性缀加平面波(FPLAPW)方法,在广义梯度近似(GGA)+自旋轨道耦合(SOC)+自旋极化(SP)下计算了具有AuCu3构型的Pu3M和PuM3(M=Ga,In,Sn,Ge)化合物的平衡结构、电子结构和形成热。
2.
We employ a full potential linearized augmented plane wave(FPLAPW) approach to calculate the partial density of states, which is in agreement with previous experimental results.
采用全势线性缀加平面波方法计算得到了GaN分波态密度 ,与以前实验结果一致 。
3) FLAPW
全势线性缀加平面波
1.
gmented plane wave method(FLAPW) is used to study the (001) surface of δ-Pu in the generalized-gradient approximation(GGA)and antiferromagnetic(AFM)configuration.
采用FLAPW(全势线性缀加平面波)方法,在广义梯度近似(GGA)、反铁磁(AFM)下研究了δ-钚(001)面的性质。
2.
The full potential linear augmented plane wave(FLAPW) method is used to study geometric and electronic structure of δ-Pu monolayers corresponding to the (100) and (111) surfaces in the generalized-gradient approximation(GGA).
采用全势线性缀加平面波(FLAPW)方法,在广义梯度近似(GGA)下研究了单层δ-钚(100)和(111)面的几何和电子结构。
4) full potential linearized augmented plane waves
全势缀加平面波
1.
Synchrotron radiation angle-resolved photoelectron spectroscopy(ARPES) combined with full potential linearized augmented plane waves(FPLAPW) calculation was performed to investigate valence band electronic structure and energy band dispersing of ZnO(000).
利用同步辐射角分辨光电子能谱(angle-resolved photoeletron spectroscopy,ARPES)并结合全势缀加平面波(full potential linearized augmented plane waves,FPLAPW)理论计算方法研究了ZnO(000)表面的价带电子结构及能带色散。
5) CASTEP
全电势线性缀加平面波法
1.
Using the first principles full potential linearized augmented plane wave(FLAPW)method and the pseudopotential plane wave(CASTEP)method,the elastic constants of Fe-based magnetic cubic phases are investigated.
通过赝势平面波法(CASTEP)及全电势线性缀加平面波法(FLAPW),以bcc_Fe为对象,研究第一性原理计算立方结构Fe基磁性材料弹性系数的方法,分析影响计算立方结构Fe基磁性材料弹性系数准确度的各项因素。
6) full-potential linerized augmented plan-wave(FLAPW)
全势线性缀加平面波方法(FLAPW)
补充资料：非线性波
见波、非线性声学。
说明：补充资料仅用于学习参考，请勿用于其它任何用途。
参考词条