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

Peter R. Surjan = a festschrift from...

Szabados, Agnes.

FindBook

Google Book

Amazon

博客來

Peter R. Surjan = a festschrift from theoretical chemistry accounts /

紀錄類型:	書目-電子資源 : Monograph/item
正題名/作者:	Peter R. Surjan/ edited by Agnes Szabados, Mihaly Kallay, Peter G. Szalay.
其他題名:	a festschrift from theoretical chemistry accounts /
其他作者:	Szabados, Agnes.
出版者:	Berlin, Heidelberg :Springer Berlin Heidelberg : : 2016.,
面頁冊數:	vi, 266 p. :ill. (some col.), digital ;24 cm.
內容註:	From the content: Preface -- Local random phase approximation with projected oscillator orbitals -- Orthogonality-constrained Hartree-Fock and perturbation theory for high-spin open-shell excited states -- On the non-integer number of particles in molecular system domains: treatment and description -- Spin contamination and noncollinearity in general complex Hartree-Fock wave functions -- Partial-wave decomposition of the ground-state wavefunction of the two-electron harmonium atom -- Use of graphics processing units for efficient evaluation of derivatives of exchange integrals by means of Fourier transformation.
Contained By:	Springer eBooks
標題:	Chemistry, Physical and theoretical. -
電子資源:	http://dx.doi.org/10.1007/978-3-662-49825-5
ISBN:	9783662498255

Peter R. Surjan = a festschrift from theoretical chemistry accounts /
Peter R. Surjana festschrift from theoretical chemistry accounts /[electronic resource] :edited by Agnes Szabados, Mihaly Kallay, Peter G. Szalay. - Berlin, Heidelberg :Springer Berlin Heidelberg :2016. - vi, 266 p. :ill. (some col.), digital ;24 cm. - Highlights in theoretical chemistry,v.122194-8666 ;. - Highlights in theoretical chemistry ;v.4..

From the content: Preface -- Local random phase approximation with projected oscillator orbitals -- Orthogonality-constrained Hartree-Fock and perturbation theory for high-spin open-shell excited states -- On the non-integer number of particles in molecular system domains: treatment and description -- Spin contamination and noncollinearity in general complex Hartree-Fock wave functions -- Partial-wave decomposition of the ground-state wavefunction of the two-electron harmonium atom -- Use of graphics processing units for efficient evaluation of derivatives of exchange integrals by means of Fourier transformation.

In this Festschrift dedicated to the 60th birthday of Peter R. Surjan, selected researchers in theoretical chemistry present research highlights on major developments in the field. Originally published in the journal Theoretical Chemistry Accounts, these outstanding contributions are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry and will especially benefit those research groups and libraries with limited access to the journal.

ISBN: 9783662498255

Standard No.: 10.1007/978-3-662-49825-5doiSubjects--Topical Terms:

518364
Chemistry, Physical and theoretical.

LC Class. No.: QA453.3

Dewey Class. No.: 541.2

Peter R. Surjan = a festschrift from theoretical chemistry accounts /
LDR:02261nmm a2200325 a 4500 001 2035666
003 DE-He213
005 20160930170214.0
006 m d
007 cr nn 008maaau
008 161117s2016 gw s 0 eng d
020 $a 9783662498255 $q (electronic bk.)
020 $a 9783662498248 $q (paper)
024 7 $a 10.1007/978-3-662-49825-5 $2 doi
035 $a 978-3-662-49825-5
040 $a GP $c GP
041 0 $a eng
050 4 $a QA453.3
072 7 $a PNRP $2 bicssc
072 7 $a SCI013050 $2 bisacsh
082 0 4 $a 541.2 $2 23
090 $a QA453.3 $b .P478 2016
245 0 0 $a Peter R. Surjan $h [electronic resource] : $b a festschrift from theoretical chemistry accounts / $c edited by Agnes Szabados, Mihaly Kallay, Peter G. Szalay.
260 $a Berlin, Heidelberg : $b Springer Berlin Heidelberg : $b Imprint: Springer, $c 2016.
300 $a vi, 266 p. : $b ill. (some col.), digital ; $c 24 cm.
490 1 $a Highlights in theoretical chemistry, $x 2194-8666 ; $v v.12
505 0 $a From the content: Preface -- Local random phase approximation with projected oscillator orbitals -- Orthogonality-constrained Hartree-Fock and perturbation theory for high-spin open-shell excited states -- On the non-integer number of particles in molecular system domains: treatment and description -- Spin contamination and noncollinearity in general complex Hartree-Fock wave functions -- Partial-wave decomposition of the ground-state wavefunction of the two-electron harmonium atom -- Use of graphics processing units for efficient evaluation of derivatives of exchange integrals by means of Fourier transformation.
520 $a In this Festschrift dedicated to the 60th birthday of Peter R. Surjan, selected researchers in theoretical chemistry present research highlights on major developments in the field. Originally published in the journal Theoretical Chemistry Accounts, these outstanding contributions are now available in a hardcover print format, as well as a special electronic edition. This volume provides valuable content for all researchers in theoretical chemistry and will especially benefit those research groups and libraries with limited access to the journal.
650 0 $a Chemistry, Physical and theoretical. $3 518364
650 1 4 $a Chemistry. $3 516420
650 2 4 $a Theoretical and Computational Chemistry. $3 890863
650 2 4 $a Atomic/Molecular Structure and Spectra. $3 1066408
650 2 4 $a Physical Chemistry. $3 890828
700 1 $a Szabados, Agnes. $3 2191212
700 1 $a Kallay, Mihaly. $3 2191213
700 1 $a Szalay, Peter G. $3 2191214
710 2 $a SpringerLink (Online service) $3 836513
773 0 $t Springer eBooks
830 0 $a Highlights in theoretical chemistry ; $v v.4. $3 2055620
856 4 0 $u http://dx.doi.org/10.1007/978-3-662-49825-5
950 $a Chemistry and Materials Science (Springer-11644)