Quantum Simulation

62 papers for year 2012

Quantum Simulation Research Context

This category collects papers on quantum simulation methods for chemistry, materials, many-body systems, condensed matter, and physics models.

Showing 49-60 of 62

Structural and electronic properties of 4H-cyclopenta[2,1-b,3;4-b']dithiophene S-oxide (BTO) derivatives with an S, S=O, O, SiH2, or BH2 bridge: semi-empirical and DFT study.

Banjo S, Ayobami OO, Ajibade AI

2012 PubMed Journal of molecular modeling

Structural insights into human GPCR protein OA1: a computational perspective.

Ghosh A, Sonavane U, Andhirka SK, Aradhyam GK, Joshi R

2012 PubMed Journal of molecular modeling

Substituent effects on geometric and electronic properties of iron tetraphenylporphyrin: a DFT investigation.

Wei L, She Y, Yu Y, Yao X, Zhang S

2012 PubMed Journal of molecular modeling

Suppression of spin-bath dynamics for improved coherence of multi-spin-qubit systems.

Bar-Gill N, Pham LM, Belthangady C, Le Sage D, Cappellaro P, Maze JR, Lukin MD, Yacoby A, Walsworth R.

2012 Europe PMC Nat Commun

The information-theoretic costs of simulating quantum measurements

Mark M. Wilde, Patrick Hayden, Francesco Buscemi, Min-Hsiu Hsieh

2012 arXiv arXiv preprint

The Schrödinger-Newton equation as non-relativistic limit of self-gravitating Klein-Gordon and Dirac fields

Domenico Giulini, André Großardt

2012 arXiv arXiv preprint

The use of coupled HSQC spectra to aid in stereochemical assignments of molecules with severe proton spectral overlap.

Powder-George Y, Frank J, Ramsewak RS, Reynolds WF

2012 PubMed Phytochemical analysis : PCA

Theoretical studies on the structures and detonation properties of nitramine explosives containing benzene ring.

Zhao G, Lu M

2012 PubMed Journal of molecular modeling

Theoretical study of the local reactivity of electrophiles of the type MPR3(+) (M = Cu, Ag, Au; R = -H, -Me, -Ph).

Burgos D, Olea-Azar C, Mendizabal F

2012 PubMed Journal of molecular modeling

Time-dependent quantum dynamical simulations of C2 condensation under extreme conditions.

Jakowski J, Irle S, Morokuma K

2012 PubMed Physical chemistry chemical physics : PCCP

Toward quantum simulations of biological information flow

Ross Dorner, John Goold, Vlatko Vedral

2012 arXiv arXiv preprint

Towards quantum simulations of biological information flow.

Dorner R, Goold J, Vedral V.

2012 Europe PMC Interface Focus