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1
by Wilson, Stephen
Published 1986
Springer US
Table of Contents: ...I. Basics -- 1. Introduction -- 2. Chemistry by Computer. -- 3. Computers and Computation -- II...

2
by Lewars, Errol G.
Published 2016
Springer International Publishing
Table of Contents: ...1. An Outline of What Computational Chemistry is All About -- 2. The Concept of the Potential...

3
by Lewars, Errol G.
Published 2011
Springer Netherlands
Table of Contents: ...1. An outline of what computational chemistry is all about -- 2. The concept of the potential...

4
by Lewars, Errol G.
Published 2003
Springer US
Table of Contents: ...An Outline of What Computational Chemistry is All About -- The Concept of the Potential Energy...

5
Published 2004
Springer Berlin Heidelberg
Table of Contents: ..., R.L. Johnston, S. Habershon: Applications of Evolutionary Computation in Structure Determination from...

6
Published 2004
Springer Netherlands
...As a result of the advancements in algorithms and the huge increase in speed of computers over...

7
Published 1987
Springer US
Subjects: ...Computer Applications in Chemistry...

8
Published 2010
Springer Netherlands
Subjects: ...Chemistry, Physical and theoretical...

9
by Ramachandran, K. I., Deepa, Gopakumar, Namboori, Krishnan
Published 2008
Springer Berlin Heidelberg
Table of Contents: ... Computational Methods -- High Performance Computing -- Research in Computational Chemistry and Molecular...

10
Published 1986
American Chemical Society
Subjects: ...Chemistry / Experiments / Computer simulation...

11
by Cropper, William H.
Published 1998
Springer New York
Table of Contents: ... -- Appendixes -- A. A List of the Program and Data Files on the Disk -- B. Mathematica and Physical Chemistry...

12
Published 2021
Springer International Publishing
Table of Contents: ...-type Orbitals -- Local Orbitals in Quantum Chemistry -- An introduction to discretization error...

13
by Veszprémi, Tamás, Fehér, Miklós
Published 1999
Springer US
Table of Contents: ... with the Schrödinger Equation -- 4. Quantum Chemistry: A Hierarchy of Approximations -- 5. Methods of Solution -- 6...

14
by Trzaska, Zdzislaw
Published 2023
Springer Nature Switzerland
Subjects: ...Mathematical and Computational Engineering Applications...

15
by Gatti, Fabien, Lasorne, Benjamin, Meyer, Hans-Dieter, Nauts, André
Published 2017
Springer International Publishing
Table of Contents: ... to molecular symmetry -- Introduction to numerical methods and to MCTDH -- Part III Applications: Infrared...

16
Published 1989
American Chemical Society
Subjects: ...Expert systems (Computer science) / Application...

17
Published 2014
Springer Netherlands
Table of Contents: .... Application for In Vitro and In Vivo Processes Modeling -- 11 Computational Toxicology in Drug Discovery...

18
Published 2019
Springer International Publishing
Table of Contents: ... Database and Analysis Tool -- Applications of Computational Toxicology for Risk Assessment of Food...

19
Published 2000
Springer US
Subjects: ...Applications of Mathematics...

20
Published 2002
Springer Netherlands
Table of Contents: ... Potential in Semiempirical SCF Schemes -- Quasicrystals and Momentum Space -- Quantum Chemistry Computations...