Back to Results
First PageMeta Content
Density functional theory / Crystal / Ab initio quantum chemistry methods / Møller–Plesset perturbation theory / Design for testing / Hybrid functional / Dalton / Chemistry / Theoretical chemistry / Computational chemistry


Dalton Transactions View Article Online PAPER
Add to Reading List

Document Date: 2013-03-06 12:48:07


Open Document

File Size: 1,44 MB

Share Result on Facebook

City

Barcelona / New York / Bellaterra / /

Company

C. Cazorla S. A. / Cambridge University Press / ACS / MP2 / Oxford University Press / CCS / DFT / Thin Solid Films / using MP2 / D. / /

Country

United Kingdom / Spain / /

Currency

pence / /

/

Event

Environmental Issue / Business Partnership / /

Facility

University College London / /

IndustryTerm

gas-adsorption / obvious chemical / energy level / much larger systems / metal organic frameworks / distinct systems / gas attraction / adsorption energy results / adsorption energy / greenhouse gas / Online Dalton Transactions Downloaded / energy difference / environmental applications / energy differences / energy results / energy / fossil-fuel energy plants / metal / correlation energy / energy disagreements / invaluable tools / adsorption energy differences / energy landscape / large energy cut-o / scaled-down systems / anthracene systems / quantitative information on these systems / gas molecule / Online Downloaded / Online Paper Dalton Transactions Downloaded / potential energy surface / energy calculations / Online PAPER Downloaded / renewable energy resources / larger systems / /

OperatingSystem

Fermi / /

Organization

Cambridge University / Instituto de Ciencia de Materiales / University College London / Royal Society of Chemistry / Department of Chemistry / Oxford University / /

Person

Z. Xiang / Claudio Cazorla / H. W. Pennline / Nat / J. Woods Halley / Z. Zhu / V / J. Lan / Y. Duan / Dalton Trans / B. Li / M. J. Janik / D. R. Luebke / /

Position

Prime Minister / Cao / /

Product

Mulliken / /

ProvinceOrState

New York / /

PublishedMedium

Dalton Transactions / /

Technology

hybridization / Computational Chemistry / simulation / /

URL

http /

SocialTag