Gaussian03中文用户参考手册.pdf

Gaussian

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第 1 章绪论................................................................................................................................ - 7 -

官方 Gaussian 03 文献的引用 ............................................................................................ - 7 -

推荐的附加引用.......................................................................................................... - 8 -

Gaussian 03 的功能............................................................................................................. - 8 -

基本算法...................................................................................................................... - 9 -

能量.............................................................................................................................. - 9 -

梯度和几何优化........................................................................................................ - 10 -

频率和二阶导数........................................................................................................ - 10 -

分子性质.................................................................................................................... - 11 -

溶解模型.................................................................................................................... - 11 -

手册概要............................................................................................................................ - 11 -

Gaussian 03 文档集........................................................................................................... - 12 -

第 2 章运行 Gaussian............................................................................................................ - 13 -

指定 scratch 文件的操作和位置 ...................................................................................... - 13 -

跨磁盘分割 scratch 文件......................................................................................... - 14 -

保存和删除 scratch 文件......................................................................................... - 14 -

初始化文件................................................................................................................ - 14 -

控制内存使用.................................................................................................................... - 15 -

在 UNIX 系统中运行 Gaussian ........................................................................................ - 15 -

脚本与 Gaussian...................................................................................................... - 16 -

用 NQS 批处理......................................................................................................... - 17 -

Gaussian 03 的链接........................................................................................................... - 17 -

第 3 章 Gaussian 03 的输入 .................................................................................................. - 20 -

Gaussian 03 输入概述 ....................................................................................................... - 20 -

Gaussian 03 输入部分分类 .................................................................................... - 21 -

输入语法............................................................................................................................ - 22 -

Gaussian 03 任务类型 ............................................................................................ - 23 -

模型化学............................................................................................................................ - 24 -

基组.................................................................................................................................... - 25 -

添加极化和弥散函数................................................................................................ - 27 -

附加的基组有关关键字............................................................................................ - 28 -

纯基函数与笛卡尔基函数相比较产生的问题........................................................ - 28 -

密度拟合基组.................................................................................................................... - 29 -

任务的标题部分................................................................................................................ - 29 -

分子说明概述.................................................................................................................... - 29 -

指定周期体系............................................................................................................ - 31 -

指定同位素以及其它核参数.................................................................................... - 32 -

分子力学的原子类型................................................................................................ - 32 -

指定空原子................................................................................................................ - 33 -

多步任务............................................................................................................................ - 33 -

Gaussian 03 关键字........................................................................................................... - 33 -

# ................................................................................................................................. - 34 -

剩余244页未读，继续阅读

slurry2000

2013-10-17

早就下载过了，非常全面，很好。

li_larry_lg

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Gaussian 03中文用户参考手册.pdf

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Gaussian 03中文用户参考手册.pdf

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高斯滤波递归实现

Gaussian使用教程 Y

GAUSS FILTER

Approximate using Gaussian quadrature with n = 1.

cv2.GaussianBlur具体实现

有详细代码解决利用python_OpenCV中的GaussianBlur ()函数以及cv.blur()、cv.GaussianBlur()、cv.medianBlur()、cv.bilateralFilter() 等函数来去除视频帧中的噪音，并通过辐射域增强处理、光谱域增强处理、空间域增强处理等方法来进行图像增强

cv2.GaussianBlur

解释binary = cv2.adaptiveThreshold(gray, 255, cv2.ADAPTIVE_THRESH_GAUSSIAN_C, cv2.THRESH_BINARY, 11, 2)

python ndimage.gaussian_filter_PythonnImage.gaussian_滤波器投掷runtim

ret, binary = cv.adaptiveThreshold(gray, 255, cv.ADAPTIVE_THRESH_GAUSSIAN_C, cv.THRESH_BINARY_INV, 25, 10) 哪里有问题

rdbwselect(new$ALL, kernel = "gaussian") Error in complete.cases(x) : argument "x" is missing, with no default

那么最后的threshold = cv2.adaptiveThreshold(gray, 255, cv2.ADAPTIVE_THRESH_GAUSSIAN_C, cv2.THRESH_BINARY_INV, blockSize=25, C=9)呢？

img = cv2.imread('gaussian.bmp', cv2.IMREAD_GRAYSCALE)

gaussian16手册

cannot import name 'GaussianMixture' from 'sklearn.cluster' (C:\Users\daisy\anaconda3\lib\site-packages\sklearn\cluster_init_.py)怎么解决

Gaussian PDF

sklearn.gaussian_process.GaussianProcessRegressor类进行TPS插值

量子化学计算入门-202003.pdf

该报错如何解决错误使用 doppler Spectrum type must be one of 'Jakes', 'Flat', 'Rounded', 'Bell', 'Asymmetric Jakes', 'Restricted Jakes', 'Gaussian' and 'BiGaussian'.

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