The Atom-Atom Potential Method: Applications to Organic Molecular Solids: Springer Series in Chemical Physics, cartea 43
Autor Alexander J. Pertsin, Alexander I. Kitaigorodskyen Limba Engleză Paperback – 15 dec 2011
Din seria Springer Series in Chemical Physics
- 15%
Preț: 613.80 lei - 15%
Preț: 618.19 lei - 15%
Preț: 611.43 lei - 15%
Preț: 619.75 lei - 15%
Preț: 613.80 lei - 15%
Preț: 612.55 lei - 15%
Preț: 624.14 lei - 15%
Preț: 622.42 lei - 15%
Preț: 627.14 lei - 15%
Preț: 614.24 lei - 18%
Preț: 911.05 lei - 18%
Preț: 915.58 lei - 18%
Preț: 916.03 lei - 15%
Preț: 611.89 lei - 15%
Preț: 624.77 lei - 15%
Preț: 634.24 lei - 18%
Preț: 916.64 lei - 18%
Preț: 859.33 lei - 15%
Preț: 622.29 lei - 18%
Preț: 1200.39 lei - 15%
Preț: 621.34 lei - 18%
Preț: 917.09 lei - 24%
Preț: 1327.80 lei - 18%
Preț: 924.39 lei - 18%
Preț: 1068.01 lei - 24%
Preț: 700.48 lei - 18%
Preț: 854.02 lei - 18%
Preț: 872.80 lei - 15%
Preț: 616.64 lei - 15%
Preț: 562.85 lei - 15%
Preț: 615.22 lei - 18%
Preț: 862.19 lei
Preț: 379.89 lei
Nou
Puncte Express: 570
Preț estimativ în valută:
67.22€ • 78.83$ • 59.04£
67.22€ • 78.83$ • 59.04£
Carte tipărită la comandă
Livrare economică 02-16 februarie 26
Preluare comenzi: 021 569.72.76
Specificații
ISBN-13: 9783642827143
ISBN-10: 3642827144
Pagini: 412
Ilustrații: X, 400 p.
Dimensiuni: 155 x 235 x 22 mm
Greutate: 0.58 kg
Ediția:Softcover reprint of the original 1st ed. 1987
Editura: Springer Berlin, Heidelberg
Colecția Springer
Seria Springer Series in Chemical Physics
Locul publicării:Berlin, Heidelberg, Germany
ISBN-10: 3642827144
Pagini: 412
Ilustrații: X, 400 p.
Dimensiuni: 155 x 235 x 22 mm
Greutate: 0.58 kg
Ediția:Softcover reprint of the original 1st ed. 1987
Editura: Springer Berlin, Heidelberg
Colecția Springer
Seria Springer Series in Chemical Physics
Locul publicării:Berlin, Heidelberg, Germany
Public țintă
ResearchCuprins
1. Introduction.- 2. Non-Empirical Calculations of Intermolecular Forces Between Organic Molecules.- 2.1 The Supermolecule Method.- 2.2 Perturbation Methods and Simplified Equations for the Interaction Energy.- 3. The Atom-Atom Potential Method.- 3.1 General Remarks.- 3.2 Formulation of the Atom-Atom Method.- 3.3 Determination of Atom-Atom Potentials from Crystal Data.- 3.4 The Use of Molecular Data in Deriving the Parameters of Potentials.- 3.5 Ab Initio Atom-Atom Potentials.- 3.6 Semiempirical Atom-Atom Potentials.- 4. Lattice Statics.- 4.1 The Lattice at Equilibrium.- 4.2 Determination of Equilibrium Crystal Configurations Using a Symmetry-Constrained Model.- 4.3 The Use of Atom-Atom Potentials in Predicting Stable Crystal Configurations.- 4.4 The Influence of Crystal Forces on the Molecular Conformation.- 4.5 The Atom-Atom Potential Method as an Aid in Determining Crystal Structures.- 4.6 Polymeric Crystals.- 5. Lattice Dynamics.- 5.1 General Theory.- 5.2 The Taddei-Califano Formalism and the Rigid-Molecule Approximation.- 5.3 Calculation of Force Constants Using the Atom-Atom Potential Method.- 5.4 Symmetry Properties of Force Constants.- 5.5 Experimental Tests.- 5.6 Numerical Results.- 6. Thermodynamics.- 6.1 Quasi-Harmonic Approximation.- 6.2 Cell Model.- 6.3 Comparison of the Cell Model and the Quasi-Harmonic Approximation with Computer Experiments.- 6.4 Extension of the Cell Model to Organic Molecular Crystals.- 6.5 Calculations of Polymorphic Transitions.- 7. Imperfect Crystals.- 7.1 Point Defects.- 7.2 Linear Faults.- 7.3 Planar Faults.- 7.4 Volume Defects.- References.