東華大學圖書館 |

語系: 繁體中文

說明(常見問題)

回圖書館首頁

手機版館藏查詢

登入

回首頁

切換: 標籤 | MARC模式 | ISBD

Applications of theoretical methods ...

Yamaguchi, Shoichi.

FindBook

Google Book

Amazon

博客來

Applications of theoretical methods in vibrational spectroscopy = quantum/classical mixed approach /

紀錄類型:	書目-電子資源 : Monograph/item
正題名/作者:	Applications of theoretical methods in vibrational spectroscopy/ by Shoichi Yamaguchi.
其他題名:	quantum/classical mixed approach /
作者:	Yamaguchi, Shoichi.
出版者:	Singapore :Springer Nature Singapore : : 2025.,
面頁冊數:	xvi, 232 p. :ill., digital ;24 cm.
內容註:	Basic physics for vibrational spectroscopy: electromagnetism -- Basic physics for vibrational spectroscopy: quantum mechanics -- Quantum/classical mixed approach: construction of vibrational Hamiltonian -- Quantum/classical mixed approach: computation of vibrational spectra.
Contained By:	Springer Nature eBook
標題:	Vibrational spectra. -
電子資源:	https://doi.org/10.1007/978-981-96-4628-9
ISBN:	9789819646289

Applications of theoretical methods in vibrational spectroscopy = quantum/classical mixed approach /
Yamaguchi, Shoichi.

Applications of theoretical methods in vibrational spectroscopyquantum/classical mixed approach /[electronic resource] :by Shoichi Yamaguchi. - Singapore :Springer Nature Singapore :2025. - xvi, 232 p. :ill., digital ;24 cm. - Lecture notes in chemistry,v. 1142192-6603 ;. - Lecture notes in chemistry ;v. 114..

Basic physics for vibrational spectroscopy: electromagnetism -- Basic physics for vibrational spectroscopy: quantum mechanics -- Quantum/classical mixed approach: construction of vibrational Hamiltonian -- Quantum/classical mixed approach: computation of vibrational spectra.

This book provides unique introduction for experimentalists to theoretically calculate vibrational (IR, Raman, SFG) spectra of molecules in liquid and solid phases. Vibrational spectroscopy is the most popular and valuable tool for scientists to obtain physicochemical insight into complex molecular systems. Although standard softwares of quantum chemistry calculations routinely provide predictions of spectra, this book describes dynamic aspects and spectroscopic accuracy enough to compare our experimental data directly to computations, that lack in the softwares. The quantum/classical mixed approach presented in this book allows researchers including graduate students of chemistry and physics to extract microscopic information of structure and dynamics from their vibrational spectroscopic experimental data with no help from theoreticians.

ISBN: 9789819646289

Standard No.: 10.1007/978-981-96-4628-9doiSubjects--Topical Terms:

592636
Vibrational spectra.

LC Class. No.: QC454.V5

Dewey Class. No.: 539.6

Applications of theoretical methods in vibrational spectroscopy = quantum/classical mixed approach /
LDR:02221nmm a2200337 a 4500 001 2414100
003 DE-He213
005 20250901130500.0
006 m d
007 cr nn 008maaau
008 260205s2025 si s 0 eng d
020 $a 9789819646289 $q (electronic bk.)
020 $a 9789819646272 $q (paper)
024 7 $a 10.1007/978-981-96-4628-9 $2 doi
035 $a 978-981-96-4628-9
040 $a GP $c GP
041 0 $a eng
050 4 $a QC454.V5
072 7 $a PNFS $2 bicssc
072 7 $a SCI013050 $2 bisacsh
072 7 $a PNFS $2 thema
082 0 4 $a 539.6 $2 23
090 $a QC454.V5 $b Y19 2025
100 1 $a Yamaguchi, Shoichi. $3 3790592
245 1 0 $a Applications of theoretical methods in vibrational spectroscopy $h [electronic resource] : $b quantum/classical mixed approach / $c by Shoichi Yamaguchi.
260 $a Singapore : $b Springer Nature Singapore : $b Imprint: Springer, $c 2025.
300 $a xvi, 232 p. : $b ill., digital ; $c 24 cm.
490 1 $a Lecture notes in chemistry, $x 2192-6603 ; $v v. 114
505 0 $a Basic physics for vibrational spectroscopy: electromagnetism -- Basic physics for vibrational spectroscopy: quantum mechanics -- Quantum/classical mixed approach: construction of vibrational Hamiltonian -- Quantum/classical mixed approach: computation of vibrational spectra.
520 $a This book provides unique introduction for experimentalists to theoretically calculate vibrational (IR, Raman, SFG) spectra of molecules in liquid and solid phases. Vibrational spectroscopy is the most popular and valuable tool for scientists to obtain physicochemical insight into complex molecular systems. Although standard softwares of quantum chemistry calculations routinely provide predictions of spectra, this book describes dynamic aspects and spectroscopic accuracy enough to compare our experimental data directly to computations, that lack in the softwares. The quantum/classical mixed approach presented in this book allows researchers including graduate students of chemistry and physics to extract microscopic information of structure and dynamics from their vibrational spectroscopic experimental data with no help from theoreticians.
650 0 $a Vibrational spectra. $3 592636
650 1 4 $a Spectroscopy. $3 699574
650 2 4 $a Molecular Spectroscopy. $3 3594146
650 2 4 $a Theoretical Chemistry. $3 3591855
650 2 4 $a Computational Chemistry. $3 3595554
650 2 4 $a Atomic, Molecular and Chemical Physics. $3 3538923
650 2 4 $a Surfaces, Interfaces and Thin Film. $3 3593580
710 2 $a SpringerLink (Online service) $3 836513
773 0 $t Springer Nature eBook
830 0 $a Lecture notes in chemistry ; $v v. 114. $3 3790593
856 4 0 $u https://doi.org/10.1007/978-981-96-4628-9
950 $a Chemistry and Materials Science (SpringerNature-11644)