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On the Use of Symmetry-Adapted Crystalline Orbitals in SCF-LCAO Periodic Calculations. II. Implementation of the Self-Consistent-Field Scheme and Examples

机译：关于对称自适应晶体轨道在sCF-LCaO周期计算中的应用。 II。自洽场地方案和实例的实施

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C. M. Zicovich-Wilson; R. Dovesi;
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年度 2007
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1. On the use of symmetry-adapted crystalline orbitals in SCF-LCAO periodic calculations. II. Implementation of the self-consistent-field scheme and examples [J] . Zicovich-Wilson CM., Dovesi R. International Journal of Quantum Chemistry . 1998,第5期

机译：关于在SCF-LCAO周期计算中使用对称适应的晶体轨道。二。自洽场方案的实现和实例
2. On the use of symmetry-adapted crystalline orbitals in SCF-LCAO periodic calculations. I. The construction of the symmetrized orbitals [J] . Zicovich-Wilson CM., Dovesi R. International Journal of Quantum Chemistry . 1998,第5期

机译：关于在SCF-LCAO周期计算中使用对称适应的晶体轨道。 I.对称轨道的构造
3. Nuclear spin-spin coupling constants from regular approximate relativistic density functional calculations. II. Spin-orbit coupling effects and anisotropies [J] . Jochen Autschbach, Tom Ziegler The Journal of Chemical Physics . 2000,第21期

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5. Periodicity of molecular clusters based on symmetry-adapted orbital model [O] . Takamasa Tsukamoto, Naoki Haruta, Tetsuya Kambe, -1

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7. Ionic Radical Theory of Crystalline Electro-Optical and Nonlinear Optical Effects. II. Calculation of Second Harmonic Generation Coefficient of alpha -LiIO sub 3 Crystal Using (IO Sub 3 ) exp -1 Radical Molecular Orbitals [R] . Chen, C. 1977

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On the Use of Symmetry-Adapted Crystalline Orbitals in SCF-LCAO Periodic Calculations. II. Implementation of the Self-Consistent-Field Scheme and Examples

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