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- MP2方法MP2
- 使用aug-cc-pVDZ基组附加键函数的方法,水分子四聚体负离子(H2O)4-的Ci-对称性异构体在MP2方法下被优化得到。Using aug-cc-pVDZ basis sets supplemented with diffused bond functions, the (H2O)4- isomer of the water tetramer anion in Ci-symmetry was optimized at the MP2 level.
- MP2_BM算法MP2_BM Algorithm
- MP2/AUG-cc-pVDZMP2/AUG-cc-pVDZ
- 引进了一种新的训练方法。A new training method was introduced.
- QCISD(T)//MP2QCISD (T)//MP2
- 他们商议扩展业务的最好方法。They conferred on the best way to expand business.
- QCISD(T)//MP2QCISD(T)//MP2 (full)
- 太多高中老师只是采用填鸭方法灌输学生。Too many high school teachers just spoon-feed their students.
- 二阶微扰理论(MP2)Second-order Moller-Plesset perturbation theory (MP2)
- 侦查方法methods of investigation
- 胸腺嘧啶-BH_3构型与性质的DFT和MP2研究Structures and Properties of Thymine-BH_3Complex: DFT and MP2 Calculation
- 我喜欢这一种英语教授方法。I prefer this system of teaching English.
- 你知道其他增加变化的方法吗?What other ways do you know to add variety?
- 尿嘧啶-BH_3复合物构型与性质的MP2理论研究An insight into the structures and properties for uracil-BH_3 complex with second order M?ller-plesset perturbation theory(MP2) calculations
- 这些方法已废而不用了。These methods have fallen into disuse.
- MP2/SDD 水平上优化了反应物、过渡态、中间体和产物的几何构型。The geometry optimizations of reactant, transition state, intermediate and product are made at MP_2/SDD level.
- 他们用抽签的方法来决定谁先开始。They drew lots to decide who should begin.
- 许多现代机器革新了耕作方法。Many modern machines have revolutionized farming.
- 在二级微扰理论的计算下(MP2/aug-cc-pvdz+BF),体系平衡几何的频率计算值都为正。It was found to have equilibrium geometry with all frequencies real at the second-order M? ller-Plesset perturbation (MP2/aug-cc-pvdz+BF) level.