DFT 相关文章

32位嵌入式浮点MCU系统可测性设计研究/DFT of a 32-bit Floating Point Embedded MCU System
LSC87数值协处理器的可测试性设计研究/The Study of Design For Testability of the Numeric Coproces
基于OFDM的数字电视地面广播解调芯片研究与设计/Research on Demodulator IC Design for OFDM Based DTV Te
头孢药物的量子化学研究/Study on Cephalosprins with Quantum Methods
高阶FMSA展开研究流体界面性质/Study the interfacial properties of fluid with density function
面向公差的凸轮机构设计理论与应用研究/Research on the Theory & Application of Design For Tolerancin
头孢药物的量子化学研究/Study on Cephalosprins with Quantum Methods
高阶FMSA展开研究流体界面性质/Study the interfacial properties of fluid with density function
F13和F22分子的电子动量谱研究及单原子识别的预研究
纳米圆柱孔材料的限定空间内流体的吸附及相行为
CPMD在固体表面性质研究中的应用/
二(2-噻吩甲酸)-2,4-戊二醇酯的合成与1H-NMR理论计算/Synthesis and 1H- NMR Spectroscopy Modelling of
有机胺-多酸杂化材料电子性质和稳定性的密度泛函理论研究/A DFT Study on the Electronic Properties and Stabili
Re(CN)73-和Re(CN)83-的电子光谱的TD-DFT研究/TD-DFT Study on the electronic spectrum of Re(
电弧传感自动跟踪DSP控制系统的研究/
语音识别的前端处理/
QM(DFT) and MD studies on formation mechanisms of C60 fullerenes
Bimetallic clusters supported on mesoporous silica: The effects of support inter
Surface chemistry of silicon nanoclusters
Predicting the self-assembled morphology and mechanical properties of mixtures o
Comparison of HF, HF + MP2, LDA, BLYP, and B3LYP band structures of the homopoly
The torsional potential in 2,2 prime -bipyrrole revisited: High-level ab initio
DFT makes the morphologies of anatase-TiO2 nanoparticles visible to IR spectrosc
Electron emission from diamondoids: A diffusion quantum Monte Carlo study
Removing critical errors for DFT applications to transition-metal nanoclusters:
Combined experimental and DFT-TDDFT computational study of photoelectrochemical
Time-dependent density-functional calculations for the optical spectra of molecu
SERS of benzotriazole on Ag colloid: surface structure characterization using th
Density-functional-theory-based local quasicontinuum method: prediction of dislo
The role of fluctuations in both density functional and field theory of nanosyst
Calculated structural and electronic interactions of the ruthenium dye N3 with a
Formation of a 6FDA-based ring polyimide with nanoscale cavity evaluated by DFT