找回密碼
 To register

QQ登錄

只需一步,快速開始

掃一掃,訪問微社區(qū)

打印 上一主題 下一主題

Titlebook: A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate ; Silvia A. Brandán Book 2013 The Auth

[復制鏈接]
查看: 35607|回復: 35
樓主
發(fā)表于 2025-3-21 18:01:28 | 只看該作者 |倒序瀏覽 |閱讀模式
期刊全稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate
影響因子2023Silvia A. Brandán
視頻videohttp://file.papertrans.cn/143/142274/142274.mp4
發(fā)行地址Includes supplementary material:
學科分類SpringerBriefs in Molecular Science
圖書封面Titlebook: A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate ;  Silvia A. Brandán Book 2013 The Auth
影響因子.A Structural and Vibrational Investigation into Chromyl Azide, Acetate, Perchlorate and Thiocyanate Compounds. reviews the structural and vibrational properties of chromyl azide, acetate, perchlorate, and thiocyanate from a theoretical point of view by using Density Functional Theory (DFT) methods. These compounds are extensively used in organic syntheses and the study of their structure and spectroscopy has become fundamental. .This book evaluates the best theoretical level and basis set to reproduce the experimental data existing for those compounds. To this end, the optimized geometries and wavenumbers for the normal modes of vibration are calculated and the obtained results are compared and analyzed. Also, the nature of the different types of bonds and their corresponding topological properties of electronic charge density are systematically and quantitatively investigated by using the NBO analysis and the atoms in molecules theory (AIM).
Pindex Book 2013
The information of publication is updating

書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 影響因子(影響力)




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 影響因子(影響力)學科排名




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 網(wǎng)絡公開度




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 網(wǎng)絡公開度學科排名




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 被引頻次




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 被引頻次學科排名




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 年度引用




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 年度引用學科排名




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 讀者反饋




書目名稱A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate 讀者反饋學科排名




單選投票, 共有 0 人參與投票
 

0票 0%

Perfect with Aesthetics

 

0票 0%

Better Implies Difficulty

 

0票 0%

Good and Satisfactory

 

0票 0%

Adverse Performance

 

0票 0%

Disdainful Garbage

您所在的用戶組沒有投票權(quán)限
沙發(fā)
發(fā)表于 2025-3-21 20:31:05 | 只看該作者
Charlotte Keating,Susan L. Rossell the topological properties of the electronic charge density were analyzed usingthe Bader‘s atoms in the molecules theory (AIM). Besides, a complete assignment of all observed bands in the infrared spectrum for the compound was performed combining DFT calculations with Pulay′s scaled quantum mechanics force field (SQMFF) methodology.
板凳
發(fā)表于 2025-3-22 04:20:03 | 只看該作者
Alexis E. Whitton,Diego A. Pizzagallil properties of electronic charge density were analyzed using .s atoms in the molecules theory (AIM). Besides, a complete assignment of all observed bands in the infrared spectrum for the compound was performed combining DFT calculations with Pulay’s scaled quantum mechanics force field (SQMFF) methodology.
地板
發(fā)表于 2025-3-22 05:54:07 | 只看該作者
Book 2013 properties of chromyl azide, acetate, perchlorate, and thiocyanate from a theoretical point of view by using Density Functional Theory (DFT) methods. These compounds are extensively used in organic syntheses and the study of their structure and spectroscopy has become fundamental. .This book evalua
5#
發(fā)表于 2025-3-22 12:24:47 | 只看該作者
Book 2013ypes of bonds and their corresponding topological properties of electronic charge density are systematically and quantitatively investigated by using the NBO analysis and the atoms in molecules theory (AIM).
6#
發(fā)表于 2025-3-22 15:52:36 | 只看該作者
Anna R. Docherty,Scott R. Sponheim Ph.D.ory (DFT) methods. The initial geometry was fully optimized at different theory levels and the harmonic wavenumbers were evaluated at the same levels. These results show that for the compound, a stable molecule was theoretically determined in the gas phase. Also, the characteristics and nature of th
7#
發(fā)表于 2025-3-22 17:59:53 | 只看該作者
8#
發(fā)表于 2025-3-22 22:41:06 | 只看該作者
David G. Gilbert,Bryant M. Stonem and theoretical calculations based on the density functional theory (DFT). The structural properties for the compound, such as the bonds order, charge-transfers, and topological properties were studied by means of the Natural Bond Orbital (NBO) and the Atoms in Molecules theory (AIM) investigation
9#
發(fā)表于 2025-3-23 01:50:31 | 只看該作者
10#
發(fā)表于 2025-3-23 09:21:02 | 只看該作者
 關于派博傳思  派博傳思旗下網(wǎng)站  友情鏈接
派博傳思介紹 公司地理位置 論文服務流程 影響因子官網(wǎng) 吾愛論文網(wǎng) 大講堂 北京大學 Oxford Uni. Harvard Uni.
發(fā)展歷史沿革 期刊點評 投稿經(jīng)驗總結(jié) SCIENCEGARD IMPACTFACTOR 派博系數(shù) 清華大學 Yale Uni. Stanford Uni.
QQ|Archiver|手機版|小黑屋| 派博傳思國際 ( 京公網(wǎng)安備110108008328) GMT+8, 2025-10-9 23:18
Copyright © 2001-2015 派博傳思   京公網(wǎng)安備110108008328 版權(quán)所有 All rights reserved
快速回復 返回頂部 返回列表
开化县| 陆良县| 襄城县| 达日县| 双鸭山市| 轮台县| 岚皋县| 木里| 新宁县| 驻马店市| 高密市| 翼城县| 博罗县| 资源县| 邵东县| 龙泉市| 麻栗坡县| 平定县| 德令哈市| 富裕县| 白沙| 边坝县| 黄山市| 论坛| 卓资县| 思茅市| 南溪县| 岗巴县| 喀什市| 青冈县| 福州市| 榆树市| 雅江县| 寿阳县| 晋宁县| 赤城县| 昌乐县| 孟津县| 志丹县| 图片| 泊头市|