Santos / Cluj-Napoca / Chichester / Budapest / Wallingford / Austin / Plenum / Salvador / London / Wiley / /
Company
M. Jeziorska S.A. / Gaussian Inc. / Ó 2008 Elsevier B.V. / Method HF / AMD / /
Country
Switzerland / Romania / Hungary / United Kingdom / / /
Event
FDA Phase / /
Facility
Research Institute / National Institute / /
IndustryTerm
dispersion energy components / corr energy / rst order energy components / intermolecular interaction potential energy curves / monomer carbonyl / correlation energy components / dispersion energy / energy corrections / intermolecular interaction energy components / dispersion energy contribution / given energy component / internal rotation energy barriers / positive and negative energy components / much larger systems / intermolecular interaction energy values / water network / energy values / interaction energy / rst order energy / energy difference / water systems / molecular systems / quantum chemical ab initio calculations / energy differences / energy contributions / energy results / dimer systems / dilute aqueous solutions / energy / intermolecular interaction energy / energy component / rst principle quantum chemical methods / correlation energy / energy contribution / similar systems / water hydrogen bond network / intermolecular interaction energy decomposition / oxygen site / energy components / methyl / int energy / dilute aqueous solution / energy minimum state / order energy components / intermolecular interaction energy decomposition procedure / energy component values / potential energy profiles / aqueous solutions / interaction energy decomposition / energy increases / energy calculations / potential energy curves / amide / carbonyl / gas phase / uncorrected interaction energy values / interaction energy decomposition scheme / larger systems / /
OperatingSystem
Linux / /
Organization
National Institute for Research and Development of Isotopic and Molecular Technologies / Research Institute for Solid Sate Physics and Optics / DMEU association / Romanian Ministry of Education / Laboratory for Neutron Scattering / Molecular and Biomolecular Physics Department / /
Person
R.L. Martin / J.A. Montgomery / Jr. / F. Bogár / J. Tomasi / V / A. Wolf / J.J. Dannenberg / V / R.J. Wheatley / T.H. Dunning Jr. / /
Position
asso* Corresponding author / D.J. / /
Product
I Structure II R (Å) / Cooper / ESAPT2 / /
ProvinceOrState
A.B. / New York / /
PublishedMedium
Physica B / /
Technology
Linux / Computational Chemistry / spectroscopy / /
Chemical Physics[removed]–210 Contents lists available at ScienceDirect Chemical Physics journal homepage: www.elsevier.com/locate/chemphys