Search Results for Quantum chemistry.

1.

Quantum chemistry

Author

Levine, Ira N.

Preferred Shelf Number

QD 462 L47 1970- V.1

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2.

Quantum chemistry

Author

Lowe, John P.

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3.

Quantum chemistry

Author

McQuarrie, Donald A.

Preferred Shelf Number

QD462 .M4 1983

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4.

Quantum chemistry

Author

Lowe, John P.

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5.

Quantum medicinal chemistry

Author

Carloni, Paolo. Alber, Frank (Frank Uwe) John Wiley & Sons.

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6.

Quantum medicinal chemistry

Author

Carloni, Paolo, ed. Alber, Frank Uwe, ed.

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QV 744 M5926 2003 V.17

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7.

Experimental quantum chemistry

Author

Hedvig, Péter.

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8.

Quantum organic chemistry

Author

Higasi, Keniti, 1905- Baba, Hiroaki, 1923- ort. yaz. Rembaum, Alan, ort. yaz.

Preferred Shelf Number

QD 461 H5338 1965

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9.

Elementary quantum chemistry

Author

Pilar, Frank L.

Preferred Shelf Number

QD 461 P53 1968

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10.

Basic quantum chemistry

Author

Phillips, Leon F.

Preferred Shelf Number

QD 461 P5447 1965

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11.

Introductory quantum chemistry

Author

Schug, John C., 1936-

Preferred Shelf Number

QD 462 S38 1972

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12.

Introductory quantum chemistry

Author

La Paglia, Salvatore R.

Preferred Shelf Number

QD 462 L35 1971

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13.

Introduction to quantum chemistry

Author

Gitmore, Melany.

Preferred Shelf Number

QD462 I58 2010

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14.

Propagators in quantum chemistry

Author

Linderberg, Jan. Öhrn, Yngve. John Wiley & Sons.

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15.

Quantum mechanics in chemistry

Author

Simons, Jack. Nichols, Jeffrey Allen, 1955-, ort. yaz.

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QD462 .S53 1997

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16.

Ideas of quantum chemistry

Author

Piela, Lucjan, 1943-

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17.

Physical chemistry : quantum mechanics

Author

Metiu, Horia, 1940-

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QC174.17.M35 M48 2006

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18.

Quantum mechanics in chemistry

Author

Hanna, Melvin W.

Preferred Shelf Number

QD 461 H1957 1965

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19.

Foundations of quantum chemistry

Author

Peacock, Thomas Edward.

Preferred Shelf Number

QD 462 P4 1968

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20.

Mathematics for quantum chemistry

Author

Anderson, Jay Martin.

Preferred Shelf Number

QD 461 AN237 1966

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21.

Introductory organic quantum chemistry

Author

Karagounis, Georg, 1905- Nachod, F. G., ed.

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QD 476 K1435 1962

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22.

Quantum chemistry : an introduction

Author

Kauzmann, Walter, 1916-

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QD 453 K1698 1957

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23.

Introduction to quantum chemistry

Author

Gatz, Carole R., 1933-

Preferred Shelf Number

QD 462 G37 1971

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24.

Methods of quantum chemistry

Author

Veselov, Mikhail Grigor'evich, ed. Chomet, S., ed.

Preferred Shelf Number

QD 461 V6313 1965

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25.

Advances in quantum chemistry.

Author

Löwdin, Per-Olov, 1916- ed.

Preferred Shelf Number

QD 453 AD95 Q

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26.

Principles and applications of quantum chemistry

Author

Gupta, V. P., 1942- author.

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27.

Quantum chemistry : a unified approach

Author

Cook, David B.

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QD462 C68 2012

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28.

Accurate condensed-phase quantum chemistry

Author

Manby, Frederick R.

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29.

Parallel computing in quantum chemistry

Author

Janssen, Curtis L. Nielsen, Ida M. B.

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30.

Reduced density matrices in quantum chemistry

Author

Davidson, Ernest R.

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31.

The variation method in quantum chemistry

Author

Epstein, Saul T.

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32.

A primer of quantum chemistry

Author

Goodrich, Frank Chauncey.

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QD 462 G66 1972

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33.

Introduction to applied quantum chemistry

Author

McGlynn, S. P., ed.

Preferred Shelf Number

QD 462 I58 1972

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34.

Quantum chemistry : elementary principles and methods

Author

Riggs, Noel Victor.

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QD 461 R4 1969

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35.

Modern quantum chemistry : İstanbul lectures

Author

Sinanoğlu, Oktay, ed.

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QD 453 SI61 1965 V.2

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36.

Handbook of molecular physics and quantum chemistry

Author

Wilson, Stephen,1950- ed.

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QD 461 H26 2003 V.1 (SET)

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37.

An introduction to quantum mechanics in chemistry

Author

Ratner, Mark A. Schatz, George C.

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QD462 .R28 2000

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38.

Second quantization-based methods in quantum chemistry

Author

Jørgensen, Poul, 1944- Simons, Jack.

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39.

Computational quantum chemistry II the group theory calculator

Author

Quinn, Charles M. Fowler, P. W. Redmond, David B.

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40.

Advances in chemical physics. Volume 67, Ab initio methods in quantum chemistry, Part I

Author

Lawley, K. P. Wiley InterScience (Online service)

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John Wiley http://dx.doi.org/10.1002/9780470142936

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41.

Advances in chemical physics. Volume 69, Ab initio methods in quantum chemistry, Part 2

Author

Lawley, K. P. Wiley InterScience (Online service)

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John Wiley http://dx.doi.org/10.1002/9780470142943

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42.

Non-covalent interactions in quantum chemistry and physics : theory and applications

Author

Otero de la Roza, Alberto, editor. DiLabio, Gino A., editor.

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43.

Advances in Quantum Methods and Applications in Chemistry, Physics, and Biology

Author

Hotokka, Matti. editor. Brändas, Erkki J. editor. Maruani, Jean. editor. Delgado-Barrio, Gerardo. editor. SpringerLink (Online service)

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ONLINE(332873.1)

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44.

Computational quantum chemistry molecular structure and properties in silico

Author

McDouall, Joseph J. W.

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ONLINE(343108.1)

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45.

Quantum Chemistry of Solids LCAO Treatment of Crystals and Nanostructures

Author

Evarestov, Robert A. author. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-3-642-30356-2

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46.

Quantum Systems in Chemistry and Physics Progress in Methods and Applications

Author

Nishikawa, Kiyoshi. editor. Maruani, Jean. editor. Brändas, Erkki J. editor. Delgado-Barrio, Gerardo. editor. Piecuch, Piotr. editor.

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47.

Advances in the Theory of Quantum Systems in Chemistry and Physics

Author

Hoggan, Philip E. editor. Brändas, Erkki J. editor. Maruani, Jean. editor. Piecuch, Piotr. editor. Delgado-Barrio, Gerardo. editor.

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48.

Neither physics nor chemistry a history of quantum chemistry

Author

Gavroglou, Kōstas. Simões, Ana. Project Muse.

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49.

Equilibrium molecular structures from spectroscopy to quantum chemistry

Author

Demaison, J. (Jean) Boggs, James E., 1921- Css̀zr̀, Attila G. Kroto, Harry.

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50.

Computational Chemistry Introduction to the Theory and Applications of Molecular and Quantum Mechanics

Author

Lewars, Errol G. author. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-90-481-3862-3

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51.

Erich HÜckel (1896–1980) From Physics to Quantum Chemistry

Author

Karachalios, Andreas. author. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-90-481-3560-8

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52.

Relativistic quantum chemistry the fundamental theory of molecular science

Author

Reiher, Markus. Wolf, Alexander, Dr. Wiley InterScience (Online service)

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53.

Advances in the Theory of Atomic and Molecular Systems Conceptual and Computational Advances in Quantum Chemistry

Author

Piecuch, Piotr. editor. Maruani, Jean. editor. Delgado-Barrio, Gerardo. editor. Wilson, Stephen. editor. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-90-481-2596-8

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54.

Frontiers in Quantum Systems in Chemistry and Physics

Author

Wilson, Stephen. editor. Grout, Peter J. editor. Maruani, Jean. editor. Delgado-Barrio, Gerardo. editor. Piecuch, Piotr. editor.

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http://dx.doi.org/10.1007/978-1-4020-8707-3

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55.

Atomistic Approaches in Modern Biology From Quantum Chemistry to Molecular Simulations

Author

Reiher, Markus. editor. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-3-540-38085-6

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56.

Quantum Chemistry of Solids The LCAO First Principles Treatment of Crystals

Author

Evarestov, Robert A. author. SpringerLink (Online service)

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57.

Cover image for Topics in the Theory Of Chemical and Physical Systems Proceedings of the 10th European Workshop on Quantum systemsin chemistry and physics held at Carthage, Tunisia, in September 2005

Topics in the Theory Of Chemical and Physical Systems Proceedings of the 10th European Workshop on Quantum systemsin chemistry and physics held at Carthage, Tunisia, in September 2005

Author

Lahmar, Souad. editor. Maruani, Jean. editor. Wilson, Stephen. editor. Delgado-Barrio, Gerardo. editor. SpringerLink (Online service)

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http://dx.doi.org/10.1007/978-1-4020-5460-0

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58.

COSMO-RS from quantum chemistry to fluid phase thermodynamics and drug design

Author

Klamt, Andreas.

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ScienceDirect http://www.sciencedirect.com/science/book/9780444519948

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59.

Introduction to quantum mechanics in chemistry, materials science, and biology

Author

Blinder, S. M., 1932-

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ScienceDirect http://www.sciencedirect.com/science/book/9780121060510

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60.

Molecular physics and elements of quantum chemistry : introduction to experiments and theory

Author

Haken, H. Wolf, H. C. (Hans Christoph), 1929-

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QC173.3 H3513 2004

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61.

Computational quantum chemistry an interactive guide to basis set theory

Author

Quinn, Charles M.

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ScienceDirect http://www.sciencedirect.com/science/book/9780125696821

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62.

Modern quantum chemistry : introduction to advanced electronic structure theory

Author

Szabo, Attila. Ostlund, Neil S.

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QD462 S95 1996

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63.

Molecular quantum mechanics : an introduction to quantum chemistry

Author

Atkins, Peter Williams.

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QD 462 A84 1970 V.1KS.1-11

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64.

Advanced quantum chemistry : theory of interactions between molecules and electromagnetic fields

Author

Hameka, Hendrik F.

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QD 461 H1769 1965

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65.

Theoretical chemistry : an introduction to quantum mechanics, statistical mechanics and molecular spectra for chemists

Author

Glasstone, Samuel, 1897-

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QC 171 G54 1944

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66.

Introduction to quantum mechanics : with applications to chemistry

Author

Pauling, Linus Carl, 1901- Wilson, Edgar Bright, 1908- ort. yaz.

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QC 174.1 P2842 1935

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67.

Relativistic electronic structure theory

Author

Schwerdtfeger, Peter.

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ScienceDirect http://www.sciencedirect.com/science/book/9780444512499

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68.

Kuantum kimyası

Author

McQuarrie, Donald A. Aksu, Mehmet Levent.

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QD462 M378 2017

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69.

Cover image for Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part V

Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part V

Author

Gervasi, Osvaldo. editor. Murgante, Beniamino. editor. Misra, Sanjay. editor. Gavrilova, Marina L. editor. Rocha, Ana Maria Alves Coutinho. editor.

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XX(519341.1)

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70.

Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part IV

Author

Gervasi, Osvaldo. editor. Murgante, Beniamino. editor. Misra, Sanjay. editor. Gavrilova, Marina L. editor. Rocha, Ana Maria Alves Coutinho. editor.

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XX(519260.1)

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71.

Natural Computing Algorithms

Author

Brabazon, Anthony. author. O'Neill, Michael. author. McGarraghy, Seán. author. SpringerLink (Online service)

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XX(518691.1)

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72.

Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part II

Author

Gervasi, Osvaldo. editor. Murgante, Beniamino. editor. Misra, Sanjay. editor. Gavrilova, Marina L. editor. Rocha, Ana Maria Alves Coutinho. editor.

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XX(518794.1)

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73.

Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part III

Author

Gervasi, Osvaldo. editor. Murgante, Beniamino. editor. Misra, Sanjay. editor. Gavrilova, Marina L. editor. Rocha, Ana Maria Alves Coutinho. editor.

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XX(518867.1)

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74.

Cover image for High Performance Computing 30th International Conference, ISC High Performance 2015, Frankfurt, Germany, July 12-16, 2015, Proceedings

High Performance Computing 30th International Conference, ISC High Performance 2015, Frankfurt, Germany, July 12-16, 2015, Proceedings

Author

Kunkel, Julian M. editor. Ludwig, Thomas. editor. SpringerLink (Online service)

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XX(519086.1)

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75.

Computational Science and Its Applications -- ICCSA 2015 15th International Conference, Banff, AB, Canada, June 22-25, 2015, Proceedings, Part I

Author

Gervasi, Osvaldo. editor. Murgante, Beniamino. editor. Misra, Sanjay. editor. Gavrilova, Marina L. editor. Rocha, Ana Maria Alves Coutinho. editor.

Preferred Shelf Number

XX(519112.1)

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76.

Interatomic bonding in solids fundamentals, simulation, applications

Author

Levitin, Valim.

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ONLINE(342212.1)

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John Wiley http://dx.doi.org/10.1002/9783527671557

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77.

Quantum-chemical calculations of unique molecular systems

Author

Babkin, V. A. (Vladimir Aleksandrovich), 1952- editor. Zaikov, G. E. (Gennadi¿̐ưi Efremovich), 1935- editor. Haghi, A. K., editor.

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78.

Concepts and methods in modern theoretical chemistry electronic structure and reactivity

Author

Ghosh, Swapan Kumar. Chattaraj, Pratim Kumar.

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79.

Applied Bohmian mechanics from nanoscale systems to cosmology

Author

Oriols, Xavier. Mompart, Jordi.

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80.

VCD spectroscopy for organic chemists

Author

Stephens, Philip J., 1940- Devlin, Frank J., 1949- Cheeseman, James R., 1963-

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81.

Forensic science advances and their application in the judiciary system

Author

Sapse, Danielle S. Kobilinsky, Lawrence F.

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82.

Kuantum kimyası ve fiziğinde problemler ve çözümleri

Author

Köksal, Fevzi

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QD462 K65 2012

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83.

Chemical physics electrons and excitations

Author

Larsson, Sven, 1941-

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84.

Scientific computing with multicore and accelerators

Author

Kurzak, Jakub. Bader, David A. Dongarra, J. J.

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85.

Charge and energy transfer dynamics in molecular systems

Author

May, Volkhard. Kühn, Oliver. Wiley InterScience (Online service)

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Wiley InterScience An electronic book accessible through the World Wide Web; click for information
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86.

Molecular quantum mechanics

Author

Atkins, Peter William, 1940- Friedman, R. S.

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QD462 A84 2011

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87.

Metallic systems a quantum chemist's perspective

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Allison, Thomas Clayton. Coskuner, Orkid. Gonzl̀ez, Carlos A.

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88.

Kuantum kimyası : (atom ve molekül kimyası)

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Cebe, Mustafa.

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QD462 C67 2011

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89.

Molecular symmetry and fuzzy symmetry

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Zhao, Xuezhuang.

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90.

Chemical modelling Applications and theory

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Springborg, Michael. Champagne, Benoit. Eriksson, Leif. Joswig, Jan-Ole. Simos, Theodore E.

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ONLINE(344136.1)

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http://dx.doi.org/10.1039/9781849730884

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91.

Single-ion solvation Experimental and theoretical approaches to elusive thermodynamic quantities

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Hunenberger, Philippe H. Reif, Maria M.

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92.

Density functional theory a practical introduction

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Sholl, David S. Steckel, Janice A.

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93.

Methods of molecular quantum mechanics an introduction to electronic molecular structure

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Magnasco, Valerio.

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94.

Spectroscopy and modelling of biomolecular building blocks

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Schermann, Jean-Pierre.

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95.

Chemical modelling applications and theory, volume 5

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Hinchliffe, Alan.

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96.

Molecular aggregation structure analysis and molecular simulation of crystals and liquids

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Gavezzotti, Angelo.

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97.

Elementary methods of molecular quantum mechanics

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Magnasco, Valerio.

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98.

Cover image for Trends and perspectives in modern computational science lectures presented in the International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2006) : recognised conference by the European Society of Computational Methods in Sciences and Engineering (ESCMSE)

Trends and perspectives in modern computational science lectures presented in the International Conference of Computational Methods in Sciences and Engineering (ICCMSE 2006) : recognised conference by the European Society of Computational Methods in Sciences and Engineering (ESCMSE)

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International Conference of Computational Methods in Sciences and Engineering (2006 : Chania, Greece) Maroulis, George. Simos, T. E. European Society of Computational Methods in Science and Engineering.

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99.

Calculation of NMR and EPR parameters theory and applications

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Kaupp, Martin. Bühl, Michael. Malkin, Vladimir G. John Wiley & Sons.

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100.

Charge and energy transfer dynamics in molecular systems

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May, Volkhard. Kühn, Oliver. Wiley InterScience (Online service)

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101.

Cover image for Relativistic electronic structure theory. Pt. 2, Applications (dedicated to Prof. Pekka Pyykkö on the occasion of his 60th birthday)

Relativistic electronic structure theory. Pt. 2, Applications (dedicated to Prof. Pekka Pyykkö on the occasion of his 60th birthday)

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Pyykkö, Pekka, 1941- Schwerdtfeger, Peter.

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102.

Relativistic effects in heavy-element chemistry and physics

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Hess, Bernd A., ed.

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QD 462.6.R42 R45 2003

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103.

Recent advances in quantum Monte Carlo methods Part II

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Lester, W. A., ed. Rotstein, Stuart M., ed. Tanaka, Shigenori, ed.

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QD 462 R44 2002

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104.

A chemist's guide to density functional theory

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Koch, Wolfram. Holthausen, Max C., ort. yaz.

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QD 462.6.D45 K63 2000

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105.

A chemist's guide to density functional theory

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Koch, Wolfram, author. Holthausen, Max C., author. Wiley InterScience (Online service), issuing body.

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106.

Methods of electronic-structure calculations : from molecules to solids

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Springborg, Michael.

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QD 462 S695 2000

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107.

Atom ve molekül kimyası : (kuantum kimyası)

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Cebe, Mustafa.

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QD462 .C434 1998

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108.

Recent developments and applications of modern density functional theory

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Seminario, J. M.

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109.

Molecular electrostatic potentials concepts and applications

Author

Murray, J. S. (Jane S.) Sen, K. D. (Kali Das), 1948-

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110.

Molecular quantum mechanics

Author

Atkins, Peter William, 1940- Friedman, R. S., ort. yaz.

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QD 462 A84 1996

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111.

Recent developments and applications of modern density functional theory

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Seminario, J. M.

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QD462.6.D45 R44 1996

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112.

Advances in chemical physics. Volume 93, New methods in computational quantum mechanics

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Prigogine, I. (Ilya) Rice, Stuart Alan, 1932- Wiley InterScience (Online service)

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113.

Modern density functional theory a tool for chemistry

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Seminario, J. M. Politzer, Peter, 1937-

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114.

Density-functional theory of atoms and molecules

Author

Parr, Robert G., 1921- Yang, Weitao.

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QC176.8.E4 P37 1989

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115.

Quantum mechanics for organic chemists

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Zimmerman, Howard E.

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116.

Diatomic interaction potential theory. Vol. 1, Fundamentals

Author

Goodisman, Jerry.

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