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Python for Chemists

Chapters

8. File Input/Output
9. Basic NumPy
10. Graph Plotting with Matplotlib
- Examples 1
12. Liquid–Vapour Equilibrium
14. LaTeX
19. Linear Least Squares Fitting I
28. Rotational Spectroscopy
29. Peak Finding
30. Fitting the Vibrational Spectrum of CO
31. pandas
32. Simulating a Powder Diffraction Spectrum
34. Nonlinear Fitting and Constrained Optimization
39. Atomic Structure

8. File Input/Output
9. Basic NumPy
10. Graph Plotting with Matplotlib
- Examples 1
12. Liquid–Vapour Equilibrium
14. LaTeX
19. Linear Least Squares Fitting I
28. Rotational Spectroscopy
29. Peak Finding
30. Fitting the Vibrational Spectrum of CO
31. pandas
32. Simulating a Powder Diffraction Spectrum
34. Nonlinear Fitting and Constrained Optimization
39. Atomic Structure

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Python for Chemists
10. Graph Plotting with Matplotlib
Examples

Examples

E10.3Melting and Boiling Points

Companion site to Learning Scientific Programming with Python and Python for Chemists by Christian Hill (Cambridge University Press).