What Do the Kohn−Sham Orbitals and Eigenvalues Mean?
Kohn−Sham orbitals and eigenvalues are calculated with gradient-corrected functionals for a set of small molecules (H2O, N2, CrH66-, and PdCl42-), varying basis sets and functio...
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279 publications
The Thermal Expansion of Pure Metals: Copper, Gold, Aluminum, Nickel, and Iron
Extremely accurate determinations of the linear thermal expansions have been made interferometrically from --- 196\ifmmode^\circ\else\textdegree\fi{}C to temperatures about +400...
Role of ubiquinone in the mitochondrial generation of hydrogen peroxide
Antimycin-inhibited bovine heart submitochondrial particles generate O2- and H2O2 with succinate as electron donor. H2O2 generation involves the action of the mitochondrial supe...
Blood pressure and cardiovascular disease in the Asia Pacific region
About half of the world's cardiovascular burden is predicted to occur in the Asia Pacific region. Blood pressure is an important determinant of this burden, with considerable po...
Sunscreens Suppress Cutaneous Vitamin D<sub>3</sub>Synthesis*
Sunscreens block the cutaneous absorption of UV-B radiation and prevent sunburning, premature aging, and cancer of the skin. Inasmuch as UV-B radiation is also responsible for t...
Tertiary marine paleotemperatures
Research Article| November 01, 1975 Tertiary marine paleotemperatures SAMUEL M. SAVIN; SAMUEL M. SAVIN 1Department of Earth Sciences, Case Western Reserve University, Cleveland,...
Demonstration of Amyloid Deposits and Neurofibrillary Changes in Whole Brain Sections
Selective and sensitive silver staining of extracellular amyloid deposits and intraneuronal neurofibrillary changes can be applied to 50–150 μ.m thick polyethylene glycol sectio...
Measurement of Separate Cosmic-Ray Electron and Positron Spectra with the Fermi Large Area Telescope
We measured separate cosmic-ray electron and positron spectra with the Fermi Large Area Telescope. Because the instrument does not have an onboard magnet, we distinguish the two...
The molecular orbital theory of chemical valency VIII. A method of calculating ionization potentials
An analysis of the ‘linear combination of atomic orbitals’ approximation using the accurate molecular orbital equations shows that it does not lead to equations of the form usua...
Assessment of Gaussian-2 and density functional theories for the computation of ionization potentials and electron affinities
A set of 146 well-established ionization potentials and electron affinities is presented. This set, referred to as the G2 ion test set, includes the 63 atoms and molecules whose...
A Service‐Orientated Approach to Marketing of Services
Looks at the author's research among several companies in Sweden and Finland with regard to market‐orientation of service as against physical goods. Found the main difference be...
Does Governance Matter? <i>Keiretsu</i> Alliances and Asset Specificity as Sources of Japanese Competitive Advantage
This empirical study suggests that Japanese competitive advantage in complex-product industries is at least partly due to differences in value chain governance and interfirm ass...