All Faculty and Research Staff Publications

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Weinhold F. Geometrical Aspects of Equilibrium Thermodynamics. In: Eyring H, Henderson D Vol. 3. New York, NY: Academic Press; 1978. pp. 15-54.
Weinhold F. Natural bond orbital analysis of photochemical excitation, with illustrative applications to vinoxy radical. Computational Methods In Photochemistry. 2005 ;13:393-476.
Weinhold F. Metric geometry of equilibrium thermodynamics. IV. Vector-algebraic evaluation of thermodynamic derivatives. The Journal of Chemical Physics. 1975 ;63:2496-2501.
Weinhold F, Brunck TK. PRINCIPLE OF MAXIMUM OVERLAP. Journal of the American Chemical Society. 1976 ;98:3745-3749.
Weinhold F. New formulas for lower bounds to expectation values. Physical Review. 1969 ;183:142-147.
Weinhold F. Natural Bond Orbital Methods Schreiner PR. 1998 ;3:1792-1811.
Weinhold F, Glendening ED. Comment on "Natural Bond Orbitals and the Nature of the Hydrogen Bond". J Phys Chem A. 2018 ;122:724-732.
Weinhold F. Metric geometry of equilibrium thermodynamics. V. Aspects of heterogeneous equilibrium. The Journal of Chemical Physics. 1976 ;65:559-564.
Weinhold F, Wang PSC. On a formula of Braun and Rebane for variational bounds to overlap. International Journal of Quantum Chemistry. 1971 ;5:215-220.
Weinhold F, Klein RA. What is a hydrogen bond? Mutually consistent theoretical and experimental criteria for characterizing H-bonding interactions. Molecular Physics. 2012 ;110:565-579.
Weinhold F. Chemistry: A new twist on molecular shape. Nature. 2001 ;411:539-541.
Weinhold F. Dickinson energy of H2+. The Journal of Chemical Physics. 1971 ;54:521-529.
Weinhold F, Klein RA. Anti-Electrostatic Hydrogen Bonds. Angewandte Chemie-International Edition. 2014 ;53:11214-11217.
Weinhold F. Upper and lower bounds to quantum-mechanical sum rules. Journal of Physics A: General Physics. 1968 ;1:655-660.
Weinhold F. Why Do Cumulene Ketones Kink?. Journal of Organic Chemistry. 2017 ;82:12238-12245.
Weinhold F. Geometric representation of equilibrium thermodynamics. Accounts of Chemical Research. 2002 ;9:236-240.
Weinhold F, Landis CR. High bond orders in metal-metal bonding. Science. 2007 ;316:61-63.
Weinhold F. Metric geometry of equilibrium thermodynamics. III. Elementary formal structure of a vector-algebraic representation of equilibrium thermodynamics. The Journal of Chemical Physics. 1975 ;63:2488-2495.

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