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Computational quantum chemistry.. II...

Fowler, Patrick W.

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Computational quantum chemistry.. II,. the group theory calculator /

紀錄類型:	書目-語言資料,印刷品 : Monograph/item
正題名/作者:	Computational quantum chemistry./ Charles M. Quinn, Patrick W. Fowler, David B. Redmond.
其他題名:	Group theory calculator
作者:	Quinn, Charles M.
其他作者:	Fowler, Patrick W.
出版者:	Amsterdam ;Academic Press, : c2005.,
面頁冊數:	viii, 188 p. :ill. (some col.) ;26 cm. +1 CD-ROM.
附註:	Accompanying CD-ROM contains interactive files, based on EXCEL spreadsheet technology controlled by Visual Basic code, can be used to perform straightforwardly group-theory analyses for direct application to the simplification of physical problems in Chemistry, Physics and even Engineering Science.
內容註:	1. Operating instructions for the Group Theory Calculator -- 2. Geometry, orbits and decorations -- 3. Decorations of orbits using local functions... -- 4. Symmetrical powers and their applications -- Appendix 1. The icosahedral harmonics -- Appendix 2. Quantum chemistry on an EXCEL spreadsheet -- Appendix 3. Sample input files for the ApianusII.exe and FunctionalPlot.exe programmes on the CDROM -- Bibliographys -- Index.
標題:	Quantum chemistry - Data processing. -
ISBN:	0123704561$b(hbk.) :

Computational quantum chemistry.. II,. the group theory calculator /
Quinn, Charles M.

Computational quantum chemistry.II,the group theory calculator /Group theory calculatorCharles M. Quinn, Patrick W. Fowler, David B. Redmond. - Amsterdam ;Academic Press,c2005. - viii, 188 p. :ill. (some col.) ;26 cm. +1 CD-ROM.

Accompanying CD-ROM contains interactive files, based on EXCEL spreadsheet technology controlled by Visual Basic code, can be used to perform straightforwardly group-theory analyses for direct application to the simplification of physical problems in Chemistry, Physics and even Engineering Science.

Includes bibliographical references (p. [185]) and index.

1. Operating instructions for the Group Theory Calculator -- 2. Geometry, orbits and decorations -- 3. Decorations of orbits using local functions... -- 4. Symmetrical powers and their applications -- Appendix 1. The icosahedral harmonics -- Appendix 2. Quantum chemistry on an EXCEL spreadsheet -- Appendix 3. Sample input files for the ApianusII.exe and FunctionalPlot.exe programmes on the CDROM -- Bibliographys -- Index.

"...describes the group theory that the authors have developed in the past twenty-five years and illustrates how this approach, known as the 'Spherical Shell' method, can be applied to solve a variety of problems that benefit from a group theory analysis"--Publisher's web page.

CD-ROM requirements on p. vii-viii of Preface.

ISBN: 0123704561$b(hbk.) :NT$4748Subjects--Topical Terms:

592596
Quantum chemistry
--Data processing.

LC Class. No.: QD462.6.D38 / Q352 2005

Computational quantum chemistry.. II,. the group theory calculator /
LDR:01939nam _2200253 a_450 001 626059
005 19980215155147.0
008 080212s2005 ne a b 001 0 eng
020 $a 0123704561$b(hbk.) : $c NT$4748
020 $a 9780123704566$b(hbk.)
020 $a 0123704573$b(CD-ROM)
020 $a 9780123704573$b(CD-ROM)
035 $a 00444226
040 $a CIN $c CIN
050 4 $a QD462.6.D38 $b Q352 2005
100 $a Quinn, Charles M. $3 592595
245 1 0 $a Computational quantum chemistry. $c Charles M. Quinn, Patrick W. Fowler, David B. Redmond. $n II, $p the group theory calculator /
246 3 0 $a Group theory calculator
246 3 $a Computational quantum chemistry 2 : $b the group theory calculator
260 $a Amsterdam ; $a San Diego, Calif. : $c c2005. $b Academic Press,
300 $a viii, 188 p. : $b ill. (some col.) ; $c 26 cm. + $e 1 CD-ROM.
500 $a Accompanying CD-ROM contains interactive files, based on EXCEL spreadsheet technology controlled by Visual Basic code, can be used to perform straightforwardly group-theory analyses for direct application to the simplification of physical problems in Chemistry, Physics and even Engineering Science.
504 $a Includes bibliographical references (p. [185]) and index.
505 2 $a 1. Operating instructions for the Group Theory Calculator -- 2. Geometry, orbits and decorations -- 3. Decorations of orbits using local functions... -- 4. Symmetrical powers and their applications -- Appendix 1. The icosahedral harmonics -- Appendix 2. Quantum chemistry on an EXCEL spreadsheet -- Appendix 3. Sample input files for the ApianusII.exe and FunctionalPlot.exe programmes on the CDROM -- Bibliographys -- Index.
520 $a "...describes the group theory that the authors have developed in the past twenty-five years and illustrates how this approach, known as the 'Spherical Shell' method, can be applied to solve a variety of problems that benefit from a group theory analysis"--Publisher's web page.
538 $a CD-ROM requirements on p. vii-viii of Preface.
650 $a Quantum chemistry $x Data processing. $3 592596
650 $a Combinatorial group theory. $3 546775
700 $a Fowler, Patrick W. $3 620916
700 $a Redmond, David B. $3 620917