Quantum Chemistry

165 papers for year 2017

Quantum Chemistry Research Context

This Quantum Articles category organizes published quantum research papers so readers can browse focused work by topic, source, and year.

Showing 157-165 of 165

Towards hyperpolarization of oil molecules via nitrogen-vacancy centers in diamond

P. Fernández-Acebal, O. Rosolio, J. Scheuer, C. Müller, S. Müller, S. Schmitt, L. P. McGuinness, I. Schwarz, Q. Chen, A. Retzker, B. Naydenov, F. Jelezko, M. B. Plenio

2017 arXiv arXiv preprint

Towards macroscopic spin and mechanical superposition via Rydberg interaction

Mohammadsadegh Khazali

2017 arXiv arXiv preprint

Tunable High Harmonic Pulses from Nanorings Swirled by Optical Vortices

J. Wätzel, J. Berakdar

2017 arXiv arXiv preprint

Two-level Chebyshev filter based complementary subspace method: pushing the envelope of large-scale electronic structure calculations

Amartya S. Banerjee, Lin Lin, Phanish Suryanarayana, Chao Yang, John E. Pask

2017 arXiv arXiv preprint

Upper limit on nonlinear optical processes: shift current and second harmonic generation in extended systems

Liang Z. Tan, Andrew M. Rappe

2017 arXiv arXiv preprint

Utilizing Microcavities to Suppress Third-order Cascades in Fifth-order Raman Spectra

Zhedong Zhang, Kochise Bennett, Vladimir Chernyak, Shaul Mukamel

2017 arXiv arXiv preprint

Vacuum energy of one-dimensional supercritical Dirac-Coulomb system

Andrey Davydov, Konstantin Sveshnikov, Yulia Voronina

2017 arXiv arXiv preprint

Variational treatment of electron-polyatomic molecule scattering calculations using adaptive overset grids

Loren Greenman, Robert R. Lucchese, C. William McCurdy

2017 arXiv arXiv preprint

WavePacket: A Matlab package for numerical quantum dynamics. II: Open quantum systems, optimal control, and model reduction

Burkhard Schmidt, Carsten Hartmann

2017 arXiv arXiv preprint