All Faculty and Research Staff Publications

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Weinhold F. Electric Polarizabilities of Two-Electron Atoms by a Lower-Bound Procedure. 1972 ;327:209-227.
Weinhold F, Chinen AB. Variational wavefunctions for H2+. The Journal of Chemical Physics. 1972 ;56:3798-3801.
Weinhold F. Rebuttal to the Bickelbaupt-Baerends case for steric repulsion causing the staggered conformation of ethane. Angewandte Chemie-International Edition. 2003 ;42:4188-4194.
Weinhold F. Improved lower bounds to expectation values. Journal of Physics A: General Physics. 1968 ;1:535-538.
Weinhold F, Klein RA. What is a hydrogen bond? Resonance covalency in the supramolecular domain. Chemistry Education Research and Practice. 2014 ;15:276-285.
Weinhold F. Chemical bonding as a superposition phenomenon. Journal of Chemical EducationJournal of Chemical Education. 1999 ;76:1141-1146.
Weinhold F. Remarks on the calculation of upper and lower limits to quantum-mechanical properties. International Journal of Quantum Chemistry. 2009 ;5:721-728.
Weinhold F. Metric geometry of equilibrium thermodynamics. The Journal of Chemical Physics. 1975 ;63:2479-2483.
Weinhold F. Improved Lower Bounds to the Overlap Integral of an Approximate Wavefunction with the True Wavefunction. The Journal of Chemical Physics. 1967 ;46:2448-2449.
Weinhold F. Natural bond orbital analysis: A critical overview of relationships to alternative bonding perspectives. Journal of Computational Chemistry. 2012 ;33:2363-2379.
Weinhold F. Variational extensions of lower bounds to expectation values. Physical Review A. 1970 ;1:122-124.
Weinhold F. MASS POLARIZATION AND BREIT-PAULI CORRECTIONS FOR THE POLARIZABILITY OF HE-4. Journal of Physical Chemistry. 1982 ;86:1111-1116.
Weinhold F, Landis CR, Glendening ED. What is NBO analysis and how is it useful?. International Reviews in Physical Chemistry. 2016 ;35:399-440.
Weinhold F, Jr EBWilson. Reduced density matrices of atoms and molecules. II. On the N-representability problem. The Journal of Chemical Physics. 1967 ;47:2298-2311.
Weinhold F. Quantum cluster equilibrium theory of liquids: General theory and computer implementation. Journal of Chemical Physics. 1998 ;109:367-372.
Weinhold F. Partitioning Technique for Determinantal Equations. In: Calais J, O. G, J. L, Y. Ö Boston, MA: Springer; 1976. pp. 307-314.
Weinhold F. Variational calculation of continuum corrections to overlap. The Journal of Chemical Physics. 1973 ;59:355-362.
Weinhold F. Comments on Purser's article: "Lewis structures are models for predicting molecular structure, not electronic structure". Journal of Chemical Education. 2005 ;82:NIL_3-NIL_4.

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