Gaussian09 Manual
User Manual:
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- 官方Gaussian 09文献的引用
- 第1部分 设置和运行Gaussian计算
- 第2部分 Gaussian 09的关键词，LINK0命令和工具
- Gaussian 09关键词
- #
- ADMP
- AM1
- Amber
- B3LYP
- BD
- BOMD
- CacheSize
- CASSCF
- CBS方法
- CBSExtrapolate
- CCD和CCSD
- Charge
- ChkBasis
- CID和CISD
- CIS和CIS(D)
- CNDO
- Complex
- Constants
- Counterpoise
- CPHF
- Density
- DensityFit
- 密度泛函（DFT）方法
- DFTB和DFTBA
- Dreiding
- EOMCCSD
- EPT
- ExtendedHuckel
- External
- ExtraBasis和ExtraDensityBasis
- 冻芯选项
- Field
- FMM
- Force
- Freq
- G1-G4方法
- Gen，GenECP
- GenChk
- Geom
- GFInput
- GFPrint
- Guess
- GVB
- HF
- Huckel
- INDO
- Integral
- IOp
- IRC
- IRCMax
- LSDA
- MaxDisk
- MINDO3
- 分子力学方法
- MNDO
- MP和双杂化DFT方法
- Name
- NMR
- NoDensityFit
- ONIOM
- Opt
- Output
- OVGF
- PBC
- PM3
- PM6
- Polar
- Population
- Pressure
- Prop
- Pseudo
- Punch
- QCISD
- 重新开始计算
- SAC-CI
- Scale
- Scan
- SCF
- SCRF
- 半经验方法
- SP
- Sparse
- Stable
- Symmetry
- TD
- Temperature
- Test
- TestMO
- TrackIO
- Transformation
- UFF
- Units
- Volume
- W1方法
- ZINDO
- 链接0命令总结
- 实用程序
- Gaussian 09关键词
- 附录
- 参考文献