Back to Results
First PageMeta Content
Quantum chemistry / Møller–Plesset perturbation theory / Hartree–Fock method / Basis set superposition error / MP2 / MPEG-1 Audio Layer II / Molecular orbital / Gaussian / Perturbation theory / Chemistry / Computational chemistry / Theoretical chemistry


Theoretical Study of Hydrogen Bonds Between Acetylene and Selected Proton Donor Systems ´ . VIBO ´ K,2 G. J. HALA ´ SZ,3 S. SUHAI4
Add to Reading List

Document Date: 2011-06-28 10:46:39


Open Document

File Size: 197,70 KB

Share Result on Facebook

City

Cluj-Napoca / Heidelberg / MONOMER / London / BENDE ET / /

Company

Hewlett-Packard / Vaux / NCH / CHA / Compaq / ACETYLENE AND PROTON DONOR SYSTEMS / Selected Proton Donor Systems / Wiley Periodicals Inc. / E HF / Wiley InterScience / /

Country

Romania / Hungary / /

Currency

pence / /

/

Facility

HCl complex / Debrecen University / HF complex / HCN complex / University of Debrecen Institute / /

IndustryTerm

projection operator / intermolecular binding energy / interaction energy contributions / earlier developed energy decomposition scheme / auxiliary operator / conventional energy / interaction energy / energy difference / interaction energy minima / molecular systems / energy differences / energy / energy correction / energy contribution / energy decomposition / weakest systems / energy components / energy decomposition procedure / energy calculation / secondorder energy corrections / potential energy surface / secondorder interaction energy correction / performed secondorder energy component analysis / appropriate second-order energy / zero-order energy / /

OperatingSystem

Linux / /

Organization

Debrecen University / National Institute for Research and Development of Isotopic and Molecular Technologies / University of Debrecen Institute of Informatics / V CHA / Hungarian Academy of Sciences / Molecular Biophysics Department / German Cancer Research Center / Department of Theoretical Physics / European Union / /

Product

BSSE / /

ProgrammingLanguage

J / /

ProvinceOrState

Alabama / /

PublishedMedium

International Journal of Quantum Chemistry / /

Technology

Alpha / Linux / /

URL

www.interscience.wiley.com / /

SocialTag