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Electrostatics at the Molecular Level [Minkštas viršelis]

  • Formatas: Paperback / softback, 113 pages, aukštis x plotis: 254x178 mm, weight: 333 g
  • Serija: IOP Concise Physics
  • Išleidimo metai: 30-Oct-2018
  • Leidėjas: Morgan & Claypool Publishers
  • ISBN-10: 1643271830
  • ISBN-13: 9781643271835
  • Formatas: Paperback / softback, 113 pages, aukštis x plotis: 254x178 mm, weight: 333 g
  • Serija: IOP Concise Physics
  • Išleidimo metai: 30-Oct-2018
  • Leidėjas: Morgan & Claypool Publishers
  • ISBN-10: 1643271830
  • ISBN-13: 9781643271835
Electrostatic forces are essential for the hierarchical structure of matter: electrons are bound to the atomic nucleus by electrostatic forces; atoms carry (partial) charges and ions with opposite charges attract and form (chemical) bonds. Small residual electrostatic forces between molecules allow them to form macroscopic structures such as crystals. Electrostatic interactions explain pseudo-forces used in popular computer programs used to model properties of atoms, molecules, and proteins. By beginning with the basics and then diving deeper into the topic, this book aims to familiarize the reader with electrostatic forces at the atomic and molecular level.
Preface vii
Acknowledgments ix
Author biography x
Symbols xi
1 Introduction
1(1)
1.1 Coulomb forces at the macroscopic level
1(1)
1.2 Coulomb forces at the microscopic level
2(3)
1.3 Semi-empirical forces in molecular systems
5(1)
References
6
2 Physical principles
1(1)
2.1 Forces, potential energy, and equilibrium
7(6)
2.2 Many-particle system
7(2)
2.3 Statistical physics
9(1)
2.4 Electromagnetic waves
9(2)
2.5 Quantum mechanics
11(3)
2.5.1 Particles
11(2)
2.5.2 Electromagnetic waves
13(1)
2.6 Order of magnitudes and units
14(5)
References
19
3 Electrostatics
1(1)
3.1 Point charges
1(3)
3.2 Continuous charge distribution
4(4)
3.2.1 Poisson equation
6(2)
3.3 Multipole expansion
8(6)
3.3.1 Electric dipoles
13(1)
3.4 Scaled units
14(2)
References
16
4 Properties of atoms
1(1)
4.1 Hydrogen atom
1(5)
4.2 Hydrogen atom in static fields
6(7)
4.2.1 Electric fields
6(5)
4.2.2 Magnetic fields
11(2)
4.3 Electronic transition
13(1)
4.4 Many-electron atoms
14(2)
4.4.1 Atom in a uniform electric field
16(4)
4.4.2 Polarization
20(1)
4.4.3 Rigidity of atoms
21(1)
References
22
5 Properties of small molecules
1(1)
5.1 Charge distribution in molecules
1(4)
5.2 Intramolecular forces
5(5)
5.2.1 Attractive forces
6(2)
5.2.2 Dispersion forces
8(1)
5.2.3 Repulsion
9(1)
5.3 Chemical bonds in molecules
10(12)
5.3.1 Sodium chloride
11(5)
5.3.2 Water
16(6)
5.4 Multipole moments
22(1)
5.4.1 Dipole moment
22(1)
5.4.2 Quadrupole moment
22(1)
5.4.3 Octupole moment
23(2)
References
25
6 Intermolecular forces
1
6.1 Formation of crystals
1(2)
6.2 Water dimer
3(1)
6.3 Hydrogen bond
4(6)
6.4 Dimer orientation
10(4)
6.5 Future directions
14
References
14