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We present a computational and theoretical framework for solving the Schrödinger equation (SE) for the two–center Coulomb problem in prolate spheroidal coordinates when the energy of the SE is positive. A general and robust computer code has been produced
Thomas J. Silva, Hans Nembach, Mark Keller, Justin Shaw, Nanna Hagstrom, michael schneider, Nico Kerber, Alexander Yaroslavtsev, Erick Parra, Eric Fullerton, Oleg Shpyrko, Christian Gutt, Hermann Durr, Ezio Iacocca, Roopali Kukreja, stefano Bonetti, Emmanuelle Jal
The advent of X-ray free-electron lasers (XFELs) has revolutionized fundamental science, from atomic to condensed matter physics, from chemistry to biology, giving researchers access to X-rays with unprecedented brightness, coherence, and pulse duration
Extended x-ray absorption fine structure (EXAFS) has evolved into an unprecedented technique for local structural determination in material, chemical, and physical problems in materials science. Just as for other experimental techniques, such as x-ray and
Christopher Soles, Amanda L. Forster, Katherine Evans, Madhusudan (Madhu) Tyagi, Robert M. Elder, Timothy Sirk, Joseph Dennis, Kanae Ito, Osama Yamamuro, Hiroshi Akiba
Modern design of common adhesives, composites and polymeric parts makes use of polymer glasses that are stiff enough to maintain their shape under a high stress while still maintaining a ductile behavior after the yield point. Typically, material
Jack F. Douglas, Alexandros Chremos, Peter Basser, Ferenc Horkay
We investigate the solution and osmotic properties of uncharged compact nanogel particles over a wide range of solvent qualitiy and particle concentration by molecular dynamics simulation. The in uence of the solvent quality is characterized by changes in
Ngoc Thanh Mai Tran, Swapnil Mhatre, Heather Hill, Ching-Chen Yeh, Dipanjan Saha, David B. Newell, Angela R. Hight Walker, Chi-Te Liang, Randolph Elmquist, Albert Rigosi
Christian Clear, Juliet Pickering, Gillian Nave, Peter Uylings, Ton Raassen
High-resolution spectra of singly ionized nickel (Ni II) have been recorded using Fourier transform spectroscopy in the region 143–5555 nm (1800–70,000 cm−1) with continuous, nickel–helium hollow cathode discharge sources. An extensive analysis of
Cherno Jaye, Daniel A. Fischer, Zixuan Li, Jennings Z. Ye, Jieming Yan, Nicolas Molina, Hsu-Ming Lien, Robert Chrostowksi, Jianliang Lin, Mangolini Mangolini
Silicon-containing diamond-like carbon (DLC) is a class of thin-film materials with excellent mechanical properties, high thermal stability, and good tribological performance over a wide range of environmental conditions. While non-alloyed/non-doped DLCs