Noncovalent Forces

Noncovalent Forces

Steve Scheiner

307,89 €
IVA incluido
Disponible
Editorial:
Springer Nature B.V.
Año de edición:
2015
Materia
Química física
ISBN:
9783319141626
307,89 €
IVA incluido
Disponible
Añadir a favoritos

Computational methods, and in particular quantum chemistry, have taken the lead in our growing understanding of noncovalent forces, as well as in their categorization. This volume describes the current state of the art in terms of what we now know, and the current questions requiring answers in the future. Topics range from very strong (ionic) to very weak (CH--π) interactions. In the intermediate regime, forces to be considered are H-bonds, particularly CH--O and OH--metal, halogen, chalcogen, pnicogen and tetrel bonds, aromatic stacking, dihydrogen bonds, and those involving radicals. Applications include drug development and predictions of crystal structure.

Artículos relacionados

  • MARIE SKLODOWSKA CURIE
    Irina Rodica Rabeja
    Marie Sklodowska Curie (7 November 1867 – 4 July 1934) was one of the greatest scientific minds that brought a fundamental contribution in science opening the door to the understanding/knowledge of the structure of the atom in the 20th century.                 Marie Sklodowska Curie’s hypothesis that the spontaneous emission of powerful rays by some chemical elements, emission ...
    Disponible

    89,28 €

  • COMPUTER SIMULATIONS OF MOLECULES AND CONDENSED MATTER
    En-Ge Wang / Xin-Zheng Li / XIN-ZHENG LI & EN-GE WANG
    This book provides a relatively complete introduction to the methods used in computational condensed matter. A wide range of electronic structure theories are introduced, including traditional quantum chemistry methods, density functional theory, many-body perturbation theory, and more. Molecular dynamics simulations are also discussed, with extensions to enhanced sampling and ...
    Disponible

    123,83 €

  • APPLIED THEORETICAL ORGANIC CHEMISTRY
    DEAN J TANTILLO
    This book provides state-of-the-art information on how studies in applied theoretical organic chemistry are conducted. It highlights the many approaches and tools available to those interested in using computational chemistry to predict and rationalize structures and reactivity of organic molecules. Chapters not only describe theoretical techniques in detail, but also describe ...
    Disponible

    277,44 €

  • ELECTROANALYTICAL METHODS
    S Rani
    'Electroanalytical Methods' is a pivotal text that offers a comprehensive exploration of electrochemistry and its numerous applications across a wide array of scientific disciplines, including earth science, life science, physical science, biochemistry, and pharmaceutical chemistry. This book is an invaluable resource for chemistry graduates, underlining the increasing necessit...
    Disponible

    18,75 €

  • Hexaaminecobalt décodée par XANES et FEFF
    Abdelhafid Mimouni
    Bienvenue dans ce voyage à travers le monde fascinant de la spectroscopie d’absorption des rayons X et de l’hexaaminecobalt. Ce livre explore en profondeur la théorie des approximations et la formule EXAFS, mettant en lumière l’importance du couplage spin-orbite et son impact sur les niveaux d’énergie dans les systèmes de transition. Nous discuterons également de l’importance d...
  • Dépôt électrolytique de nanofils
    Abderahman Ali / Saliema Baha
    Les processus électrochimiques jouent un rôle très important dans la préparation d’une grande variété de matériaux. Cette étude avait pour but d’examiner l’électrodéposition de nanofils et l’applicabilité de la déposition électrochimique aux nanoparticules. Dans ce travail, la fabrication de nanofils à l’aide de différentes méthodes électrochimiques a été brièvement passée en r...

Otros libros del autor

  • Tetrel Bonds
    Steve Scheiner
    The replacement of the bridging H atom in H-bonds by a multitude of other, more electronegative, atoms has led to the rapidly growing study of related noncovalent bonds generally known as halogen, chalcogen, and pnicogen bonds. It has recently been recognized that elements of the tetrel family (C, Si, Ge, Sn, Pb) also engage in such bonds, wherein the tetrel atom serves as an e...
    Disponible

    81,61 €

  • Noncovalent Forces
    Steve Scheiner
    Computational methods, and in particular quantum chemistry, have taken the lead in our growing understanding of noncovalent forces, as well as in their categorization. This volume describes the current state of the art in terms of what we now know, and the current questions requiring answers in the future. Topics range from very strong (ionic) to very weak (CH--π) interactions....
    Disponible

    309,24 €

  • Noncovalent Forces
    Steve Scheiner
    Computational methods, and in particular quantum chemistry, have taken the lead in our growing understanding of noncovalent forces, as well as in their categorization. This volume describes the current state of the art in terms of what we now know, and the current questions requiring answers in the future. Topics range from very strong (ionic) to very weak (CH--π) interactions....
    Disponible

    46,64 €