Professor Frank Weinhold

All Stories

1. 
   Chlorine dioxide: An exception that proves the rules of localized chemical bonding

   Article • The Journal of Chemical Physics, March 2022, American Institute of Physics

   Professor Frank Weinhold

2. 
   Improved General Understanding of the Hydrogen-Bonding Phenomena: A Reply

   Article • Angewandte Chemie, February 2015, Wiley

   Professor Frank Weinhold

3. 
   Improved General Understanding of the Hydrogen-Bonding Phenomena: A Reply

   Article • Angewandte Chemie, February 2015, Wiley

   Professor Frank Weinhold

4. 
   Addendum: Anti-Electrostatic Hydrogen Bonds

   Article • Angewandte Chemie, November 2014, Wiley

   Professor Frank Weinhold

5. 
   Addendum: Anti-Electrostatic Hydrogen Bonds

   Article • Angewandte Chemie, November 2014, Wiley

   Professor Frank Weinhold

6. 
   Anti-Electrostatic Hydrogen Bonds

   Article • Angewandte Chemie, September 2014, Wiley

   Professor Frank Weinhold

7. 
   Anti-Electrostatic Hydrogen Bonds

   Article • Angewandte Chemie, September 2014, Wiley

   Professor Frank Weinhold

8. 
   Kinetics and Mechanism of Water Cluster Equilibria

   Article • The Journal of Physical Chemistry B, July 2014, American Chemical Society (ACS)

   Professor Frank Weinhold

9. 
   Bay-type H···H “bonding” in cis-2-butene and related species: QTAIM versus NBO description

   Article • Journal of Computational Chemistry, June 2014, Wiley

   Professor Frank Weinhold

10. 
    The NBO View of Chemical Bonding

    Article • May 2014, Wiley

    Professor Frank Weinhold

11. 
    What is a hydrogen bond? Resonance covalency in the supramolecular domain

    Article • Chemistry Education Research and Practice, January 2014, Royal Society of Chemistry

    Professor Frank Weinhold

12. 
    Rabbit-ears hybrids, VSEPR sterics, and other orbital anachronisms

    Article • Chemistry Education Research and Practice, January 2014, Royal Society of Chemistry

    Professor Frank Weinhold, Professor John W Moore

13. 
    Quantum Cluster Equilibrium

    Article • January 2014, Springer Science + Business Media

    Professor Frank Weinhold

14. 
    Erratum: NBO 6.0: Natural bond orbital analysis program

    Article • Journal of Computational Chemistry, June 2013, Wiley

    Professor Frank Weinhold

15. 
    Hyperconjugative Interactions in Permethylated Siloxanes and Ethers: The Nature of the SiO Bond

    Article • Journal of the American Chemical Society, April 2013, American Chemical Society (ACS)

    Professor Frank Weinhold

16. 
    NBO 6.0: Natural bond orbital analysis program

    Article • Journal of Computational Chemistry, March 2013, Wiley

    Professor Frank Weinhold

17. 
    Natural bond orbital analysis: A critical overview of relationships to alternative bonding perspectives

    Article • Journal of Computational Chemistry, July 2012, Wiley

    Professor Frank Weinhold

18. 
    Natural bond critical point analysis: Quantitative relationships between natural bond orbital-based and QTAIM-based topological descriptors of chemical bonding

    Article • Journal of Computational Chemistry, July 2012, Wiley

    Professor Frank Weinhold

19. 
    Discovering Chemistry with Natural Bond Orbitals

    Article • July 2012, Wiley

    Professor Frank Weinhold

20. 
    What is a hydrogen bond? Mutually consistent theoretical and experimental criteria for characterizing H-bonding interactions

    Article • Molecular Physics, May 2012, Taylor & Francis

    Professor Frank Weinhold

21. 
    Accurate Structure and Dynamics of the Metal-Site of Paramagnetic Metalloproteins from NMR Parameters Using Natural Bond Orbitals

    Article • Journal of the American Chemical Society, March 2012, American Chemical Society (ACS)

    Professor Frank Weinhold

22. 
    The Nature of the Silicon–Oxygen Bond

    Article • Organometallics, November 2011, American Chemical Society (ACS)

    Professor Frank Weinhold

23. 
    Natural Bond Orbitals and Lewis-Like Structures of Copper Blue Proteins

    Article • September 2011, Wiley

    Professor Frank Weinhold

24. 
    Natural bond orbital methods

    Article • Wiley Interdisciplinary Reviews Computational Molecular Science, June 2011, Wiley

    Professor Frank Weinhold

25. 
    Isotope-Sensitive Degenerate [1,3]-Hydrogen Migration versus Competitive Enol-Keto Tautomerization

    Article • Chemistry - A European Journal, November 2009, Wiley

    Professor Frank Weinhold

26. 
    Remarks on the calculation of upper and lower limits to quantum-mechanical properties

    Article • International Journal of Quantum Chemistry, June 2009, Wiley

    Professor Frank Weinhold

27. 
    Classical and Geometrical Theory of Chemical and Phase Thermodynamics

    Article • December 2008, Wiley

    Professor Frank Weinhold

28. 
    The ABCs of Multiple Bonding

    Article • Science, November 2007, American Association for the Advancement of Science

    Professor Frank Weinhold

29. 
    Radical hydrogen bonding: Origin of stability of radical-molecule complexes

    Article • The Journal of Chemical Physics, October 2007, American Institute of Physics

    Professor Frank Weinhold

30. 
    News from the Periodic Table: An Introduction to "Periodicity Symbols, Tables, and Models for Higher-Order Valency and Donor–Acceptor Kinships"

    Article • Journal of Chemical Education, July 2007, American Chemical Society (ACS)

    Professor Frank Weinhold

31. 
    CHEMISTRY: High Bond Orders in Metal-Metal Bonding

    Article • Science, April 2007, American Association for the Advancement of Science

    Professor Frank Weinhold

32. 
    Resonance Bonding Patterns of Peroxide Chemistry:  Cyclic Three-Center Hyperbonding in “Phosphadioxirane” Intermediates

    Article • Journal of the American Chemical Society, September 2006, American Chemical Society (ACS)

    Professor Frank Weinhold

33. 
    Determination of the Conformation of 2-Hydroxy- and 2-Aminobenzoic Acid Dimers Using 13 C NMR and Density Functional Theory/Natural Bond Order Analysis:  The Central Importance of the Carboxylic Acid Carbon

    Article • The Journal of Physical Chemistry A, July 2006, American Chemical Society (ACS)

    Professor Frank Weinhold

34. 
    Natural Bond Orbital Analysis of Photochemical Excitation, with Illustrative Applications to Vinoxy Radical

    Article • ChemInform, June 2006, Wiley

    Professor Frank Weinhold

35. 
    Origin of Trans-Bent Geometries in Maximally Bonded Transition Metal and Main Group Molecules

    Article • Journal of the American Chemical Society, June 2006, American Chemical Society (ACS)

    Professor Frank Weinhold

36. 
    Comments on Purser's Article: "Lewis Structures are Models for Predicting Molecular Structure, Not Electronic Structure"

    Article • Journal of Chemical Education, April 2005, American Chemical Society (ACS)

    Professor Frank Weinhold

37. 
    Valency and Bonding

    Article • January 2005, Cambridge University Press

    Professor Frank Weinhold

38. 
    Resonance Character of Hydrogen‐bonding Interactions in Water and Other H‐bonded Species

    Article • January 2005, Elsevier

    Professor Frank Weinhold

39. 
    Blue-Shifted and Red-Shifted Hydrogen Bonds in Hypervalent Rare-Gas FRg−H···Y Sandwiches

    Article • The Journal of Physical Chemistry A, May 2004, American Chemical Society (ACS)

    Professor Frank Weinhold, Professor Igor Alabugin

40. 
    Rebuttal to the Bickelhaupt–Baerends Case for Steric Repulsion Causing the Staggered Conformation of Ethane

    Article • Angewandte Chemie, September 2003, Wiley

    Professor Frank Weinhold

41. 
    Rebuttal to the Bickelhaupt–Baerends Case for Steric Repulsion Causing the Staggered Conformation of Ethane

    Article • Angewandte Chemie, September 2003, Wiley

    Professor Frank Weinhold

42. 
    Electronic Basis of Improper Hydrogen Bonding:  A Subtle Balance of Hyperconjugation and Rehybridization

    Article • Journal of the American Chemical Society, May 2003, American Chemical Society (ACS)

    Professor Frank Weinhold, Professor Igor Alabugin

43. 
    Quantum Chemical Calculations on Structural Models of the Catalytic Site of Chymotrypsin:  Comparison of Calculated Results with Experimental Data from NMR Spectroscopy

    Article • Journal of the American Chemical Society, December 2002, American Chemical Society (ACS)

    Professor Frank Weinhold

44. 
    Die molekulare Zusammensetzung des fl��ssigen Schwefels

    Article • Angewandte Chemie, September 2002, Wiley

    Professor Ralf Ludwig, Professor Frank Weinhold

45. 
    Molecular Composition of Liquid Sulfur

    Article • Angewandte Chemie, September 2002, Wiley

    Professor Ralf Ludwig, Professor Frank Weinhold

46. 
    Natural Bond Orbital Methods

    Article • April 2002, Wiley

    Professor Frank Weinhold

47. 
    Collagen Stability:  Insights from NMR Spectroscopic and Hybrid Density Functional Computational Investigations of the Effect of Electronegative Substituents on Prolyl Ring Conformations

    Article • Journal of the American Chemical Society, March 2002, American Chemical Society (ACS)

    Professor Frank Weinhold, Ronald Raines

48. 
    Trans-Hydrogen-Bond h2 J NN and h1 J NH Couplings in the DNA A−T Base Pair:  Natural Bond Orbital Analysis

    Article • Journal of the American Chemical Society, February 2002, American Chemical Society (ACS)

    Professor Frank Weinhold

49. 
    Quantum Cluster Equilibrium Theory of Liquids: Isotopically substituted QCE/3-21G Model Water

    Article • Zeitschrift für Physikalische Chemie, January 2002, De Gruyter

    Professor Frank Weinhold

50. 
    Natural J -Coupling Analysis:  Interpretation of Scalar J -Couplings in Terms of Natural Bond Orbitals

    Article • Journal of the American Chemical Society, December 2001, American Chemical Society (ACS)

    Professor Frank Weinhold

51. 
    NATURAL BOND ORBITALS AND EXTENSIONS OF LOCALIZED BONDING CONCEPTS

    Article • Chemistry Education Research and Practice, January 2001, Royal Society of Chemistry

    Professor Frank Weinhold

52. 
    Diamagnetism of helium

    Article • The Journal of Chemical Physics, November 2000, American Institute of Physics

    Professor Frank Weinhold

53. 
    Natural resonance theory. I. General formalism

    Article • Journal of Computational Chemistry, April 2000, Wiley

    Professor Frank Weinhold

54. 
    Origin of Methyl Internal Rotation Barriers

    Article • Accounts of Chemical Research, December 1999, American Chemical Society (ACS)

    Professor Frank Weinhold

55. 
    Chemical Bonding as a Superposition Phenomenon

    Article • Journal of Chemical Education, August 1999, American Chemical Society (ACS)

    Professor Frank Weinhold

56. 
    Natural steric analysis of internal rotation barriers

    Article • International Journal of Quantum Chemistry, January 1999, Wiley

    Professor Frank Weinhold

57. 
    Critical test of quantum cluster equilibrium theory: Formic acid at B3LYP/6-31+G* hybrid density functional level

    Article • The Journal of Chemical Physics, October 1998, American Institute of Physics

    Professor Frank Weinhold

58. 
    Inadequacies of the Point-Dipole Approximation for Describing Electron−Nuclear Interactions in Paramagnetic Proteins:  Hybrid Density Functional Calculations and the Analysis of NMR Relaxation of High-Spin Iron(III) Rubredoxin

    Article • The Journal of Physical Chemistry B, October 1998, American Chemical Society (ACS)

    Professor Frank Weinhold

59. 
    Quantum cluster equilibrium theory of liquids: General theory and computer implementation

    Article • The Journal of Chemical Physics, July 1998, American Institute of Physics

    Professor Frank Weinhold

60. 
    Quantum cluster equilibrium theory of liquids: Illustrative application to water

    Article • The Journal of Chemical Physics, July 1998, American Institute of Physics

    Professor Frank Weinhold

61. 
    NMR Investigations of Clostridium pasteurianum Rubredoxin. Origin of Hyperfine 1 H, 2 H, 13 C, and 15 N NMR Chemical Shifts in Iron−Sulfur Proteins As Determined by Comparison of Experimental Data with Hybrid Density Functional Calculations †

    Article • Journal of the American Chemical Society, May 1998, American Chemical Society (ACS)

    Professor Frank Weinhold

62. 
    Natural resonance theory: III. Chemical applications

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

63. 
    Natural resonance theory: I. General formalism

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

64. 
    Natural resonance theory: I. General formalism

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

65. 
    Natural resonance theory: II. Natural bond order and valency

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

66. 
    Natural resonance theory: III. Chemical applications

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

67. 
    Natural resonance theory: II. Natural bond order and valency

    Article • Journal of Computational Chemistry, April 1998, Wiley

    Professor Frank Weinhold

68. 
    Natural bond orbital analysis of steric interactions

    Article • The Journal of Chemical Physics, October 1997, American Institute of Physics

    Professor Frank Weinhold

69. 
    Natural chemical shielding analysis of nuclear magnetic resonance shielding tensors from gauge-including atomic orbital calculations

    Article • The Journal of Chemical Physics, July 1997, American Institute of Physics

    Professor Frank Weinhold

70. 
    High Harmonic Generation Spectra of Neutral Helium by the Complex-Scaled ( t , t ′ ) Method: Role of Dynamical Electron Correlation

    Article • Physical Review Letters, March 1997, American Physical Society (APS)

    Professor Frank Weinhold

71. 
    Threshold photoionization spectra of benzyl radical: Cation vibrational states and ab initio calculations

    Article • The Journal of Chemical Physics, June 1996, American Institute of Physics

    Professor Frank Weinhold

72. 
    Theoretical Studies of Protium/Deuterium Fractionation Factors and Cooperative Hydrogen Bonding in Peptides J . Am . Chem . Soc . 1995 , 117 , 9619−9624

    Article • Journal of the American Chemical Society, January 1996, American Chemical Society (ACS)

    Professor Frank Weinhold

73. 
    Theoretical Studies of Protium/Deuterium Fractionation Factors and Cooperative Hydrogen Bonding in Peptides

    Article • Journal of the American Chemical Society, September 1995, American Chemical Society (ACS)

    Professor Frank Weinhold

74. 
    Temperature dependence of hydrogen bonding in neat, liquid formamide

    Article • The Journal of Chemical Physics, September 1995, American Institute of Physics

    Professor Frank Weinhold

75. 
    Common Textbook and Teaching Misrepresentations of Lewis Structures

    Article • Journal of Chemical Education, July 1995, American Chemical Society (ACS)

    Professor Frank Weinhold

76. 
    Structure and spectroscopy of (HCN)n clusters: Cooperative and electronic delocalization effects in C–H⋅⋅⋅N hydrogen bonding

    Article • The Journal of Chemical Physics, July 1995, American Institute of Physics

    Professor Frank Weinhold

77. 
    Structure of Magnesium Cluster Grignard Reagents

    Article • Inorganic Chemistry, May 1995, American Chemical Society (ACS)

    Professor Frank Weinhold

78. 
    Ab Initio Calculations of Protium/Deuterium Fractionation Factors in O2H5+ Clusters

    Article • The Journal of Physical Chemistry B, May 1995, American Chemical Society (ACS)

    Professor Frank Weinhold

79. 
    Understanding barriers to internal rotation in substituted toluenes and their cations

    Article • The Journal of Chemical Physics, May 1995, American Institute of Physics

    Professor Frank Weinhold

80. 
    Calculations of one-, two- and three-bond nuclear spin-spin couplings in a model peptide and correlations with experimental data

    Article • Journal of Biomolecular NMR, July 1994, Springer Science + Business Media

    Professor Frank Weinhold

81. 
    Estimates of ? and ? torsion angles in proteins from one-, two- and three-bond nuclear spin-spin couplings: Application to staphylococcal nuclease

    Article • Journal of Biomolecular NMR, July 1994, Springer Science + Business Media

    Professor Frank Weinhold

82. 
    Use of Hueckel Methodology with ab Initio Molecular Orbitals: Polarizabilities and Prediction of Organic Reactions

    Article • Journal of the American Chemical Society, February 1994, American Chemical Society (ACS)

    Professor Frank Weinhold

83. 
    Calculation of nuclear spin-spin coupling constants with ab initio molecular orbital wave functions

    Article • The Journal of Physical Chemistry B, November 1993, American Chemical Society (ACS)

    Professor Frank Weinhold

84. 
    The role of delocalization in benzene

    Article • Journal of the American Chemical Society, November 1993, American Chemical Society (ACS)

    Professor Frank Weinhold

85. 
    Boron oxides:Ab initiostudies with natural bond orbital analysis

    Article • The Journal of Chemical Physics, January 1993, American Institute of Physics

    Professor Frank Weinhold

86. 
    Photoelectron spectroscopy of free radicals with cm−1 resolution: The benzyl cation

    Article • The Journal of Chemical Physics, December 1991, American Institute of Physics

    Professor Frank Weinhold

87. 
    Natural Bond Orbital Analysis of Internal Rotation Barriers and Related Phenomena

    Article • Israel Journal of Chemistry, January 1991, Wiley

    Professor Frank Weinhold

88. 
    Intermolecular interactions from a natural bond orbital, donor-acceptor viewpoint

    Article • Chemical Reviews, September 1988, American Chemical Society (ACS)

    Professor Frank Weinhold

89. 
    The 2Ag excited state of (CO)+2

    Article • The Journal of Chemical Physics, January 1988, American Institute of Physics

    Professor Frank Weinhold

90. 
    Transferability of natural bond orbitals

    Article • Journal of the American Chemical Society, January 1988, American Chemical Society (ACS)

    Professor Frank Weinhold

91. 
    The Natural Bond Orbital Lewis Structure Concept for Molecules, Radicals, and Radical Ions

    Article • January 1988, Springer Science + Business Media

    Professor Frank Weinhold

92. 
    Observation of an Eclipsed Csp3-CH3 Bond in a Tricyclic Orthoamide; Experimental and Theoretical Evidence for CH⃛O Hydrogen Bonds

    Article • Angewandte Chemie International Edition in English, November 1987, Wiley

    Professor Frank Weinhold

93. 
    Eine Csp3-gebundene Methylgruppe in ekliptischer Konformation; experimenteller und theoretischer Nachweis von CH … O-Wasserstoffbrücken

    Article • Angewandte Chemie, November 1987, Wiley

    Professor Frank Weinhold

94. 
    Photodissociation of (CO)+2: Theoretical studies of ground 2Bu and excited 2Bg potential energy surfaces

    Article • The Journal of Chemical Physics, July 1987, American Institute of Physics

    Professor Frank Weinhold

95. 
    Book review

    Article • Foundations of Physics, April 1987, Springer Science + Business Media

    Professor Frank Weinhold

96. 
    Theoretical studies of O2?:(H2O)n clusters

    Article • Journal of Computational Chemistry, June 1986, Wiley

    Professor Frank Weinhold

97. 
    On the role of d orbitals in sulfur hexafluoride

    Article • Journal of the American Chemical Society, June 1986, American Chemical Society (ACS)

    Professor Frank Weinhold

98. 
    Natural bond orbital analysis of molecular interactions: Theoretical studies of binary complexes of HF, H2O, NH3, N2, O2, F2, CO, and CO2 with HF, H2O, and NH3

    Article • The Journal of Chemical Physics, May 1986, American Institute of Physics

    Professor Frank Weinhold

99. 
    Some remarks on the C–H bond dipole moment

    Article • The Journal of Chemical Physics, February 1986, American Institute of Physics

    Professor Frank Weinhold

100. 
     Natural localized molecular orbitals

     Article • The Journal of Chemical Physics, August 1985, American Institute of Physics

     Professor Frank Weinhold

101. 
     Natural population analysis

     Article • The Journal of Chemical Physics, July 1985, American Institute of Physics

     Professor Frank Weinhold

102. 
     Nature of the contact ion pair trichloromethyl-chloride (CCl3+Cl-). A theoretical study

     Article • The Journal of Physical Chemistry B, June 1985, American Chemical Society (ACS)

     Professor Frank Weinhold

103. 
     A theoretical model of bonding in hyperlithiated carbon compounds

     Article • Journal of the American Chemical Society, April 1985, American Chemical Society (ACS)

     Professor Frank Weinhold

104. 
     Investigation of the differences in stability of the OC⋅⋅⋅HF and CO⋅⋅⋅HF complexes

     Article • The Journal of Chemical Physics, March 1985, American Institute of Physics

     Professor Frank Weinhold

105. 
     Syn and anti bent hydrazine radical cations. Effect of .sigma.,.pi. mixing on spectral properties

     Article • Journal of the American Chemical Society, January 1985, American Chemical Society (ACS)

     Professor Frank Weinhold

106. 
     Natural bond orbital analysis of near‐Hartree–Fock water dimer

     Article • The Journal of Chemical Physics, March 1983, American Institute of Physics

     Professor Frank Weinhold

107. 
     Coupling of internal rotations in propanelike molecules

     Article • International Journal of Quantum Chemistry, February 1982, Wiley

     Professor Frank Weinhold

108. 
     Complex-coordinate calculations with complex basis sets

     Article • September 1981, American Physical Society (APS)

     Professor Frank Weinhold

109. 
     Natural hybrid orbitals

     Article • Journal of the American Chemical Society, September 1980, American Chemical Society (ACS)

     Professor Frank Weinhold

110. 
     Criteria of accuracy of resonance eigenvalues

     Article • International Journal of Quantum Chemistry, June 1980, Wiley

     Professor Frank Weinhold

111. 
     9-(9-Borabicyclo[3.3.1]nonyl)-9-azabicyclo[3.3.1]nonane radical cation: a failure of Bredt's rule kinetic stabilization

     Article • The Journal of Organic Chemistry, May 1980, American Chemical Society (ACS)

     Professor Frank Weinhold

112. 
     Antisymmetrization effects in bond‐orbital models of internal rotation barriers

     Article • The Journal of Chemical Physics, February 1980, American Institute of Physics

     Professor Frank Weinhold

113. 
     Electron-correlation effects in the positions and widths of two-electron autoionizing resonances

     Article • July 1979, American Physical Society (APS)

     Professor Frank Weinhold

114. 
     Variation-perturbation approach to complex eigenvalues of resonance states

     Article • The Journal of Physical Chemistry B, May 1979, American Chemical Society (ACS)

     Professor Frank Weinhold

115. 
     Complex-coordinate studies of helium autoionizing resonances

     Article • International Journal of Quantum Chemistry, December 1978, Wiley

     Professor Frank Weinhold

116. 
     Resonance properties of complex-rotated hamiltonians

     Article • Molecular Physics, December 1978, Taylor & Francis

     Professor Frank Weinhold

117. 
     On the dipole moment of three identical spherical atoms

     Article • Molecular Physics, May 1978, Taylor & Francis

     Professor Frank Weinhold

118. 
     Geometrical Aspects of Equilibrium Thermodynamics

     Article • January 1978, Elsevier

     Professor Frank Weinhold

119. 
     Bivariational calculations of bounds on complex-frequency polarizabilities

     Article • The Journal of Chemical Physics, January 1978, American Institute of Physics

     Professor Frank Weinhold

120. 
     Thermodynamic paradoxes

     Article • Physics Today, January 1977, American Institute of Physics

     Professor Frank Weinhold

121. 
     G+K 1Σ+g double‐minimum excited state of H2

     Article • The Journal of Chemical Physics, January 1977, American Institute of Physics

     Professor Frank Weinhold

122. 
     Metric geometry of equilibrium thermodynamics. V. Aspects of heterogeneous equilibrium

     Article • The Journal of Chemical Physics, July 1976, American Institute of Physics

     Professor Frank Weinhold

123. 
     Conceptual model of "through-bonds" interactions

     Article • Journal of the American Chemical Society, July 1976, American Chemical Society (ACS)

     Professor Frank Weinhold

124. 
     Geometric representation of equilibrium thermodynamics

     Article • Accounts of Chemical Research, June 1976, American Chemical Society (ACS)

     Professor Frank Weinhold

125. 
     The principle of maximum overlap

     Article • Journal of the American Chemical Society, June 1976, American Chemical Society (ACS)

     Professor Frank Weinhold

126. 
     Thermodynamics and geometry

     Article • Physics Today, March 1976, American Institute of Physics

     Professor Frank Weinhold

127. 
     Partitioning Technique for Determinantal Equations

     Article • January 1976, Springer Science + Business Media

     Professor Frank Weinhold

128. 
     Erratum: Variational wavefunctions for H+2

     Article • The Journal of Chemical Physics, December 1975, American Institute of Physics

     Professor Frank Weinhold

129. 
     Metric geometry of equilibrium thermodynamics

     Article • The Journal of Chemical Physics, September 1975, American Institute of Physics

     Professor Frank Weinhold

130. 
     Metric geometry of equilibrium thermodynamics. II. Scaling, homogeneity, and generalized Gibbs–Duhem relations

     Article • The Journal of Chemical Physics, September 1975, American Institute of Physics

     Professor Frank Weinhold

131. 
     Metric geometry of equilibrium thermodynamics. IV. Vector‐algebraic evaluation of thermodynamic derivatives

     Article • The Journal of Chemical Physics, September 1975, American Institute of Physics

     Professor Frank Weinhold

132. 
     Bounds to the lifetime of the Ar XVII 2   S 3 state

     Article • February 1975, American Physical Society (APS)

     Professor Frank Weinhold

133. 
     Relative accuracy of length and velocity forms in oscillator-strength calculations

     Article • November 1974, American Physical Society (APS)

     Professor Frank Weinhold

134. 
     Dipole oscillator strengths, with rigorous limits of error, for He and Li +

     Article • January 1974, American Physical Society (APS)

     Professor Frank Weinhold

135. 
     Erratum: Dickinson energy of H2+

     Article • The Journal of Chemical Physics, July 1973, American Institute of Physics

     Professor Frank Weinhold

136. 
     Variational calculation of continuum corrections to overlap

     Article • The Journal of Chemical Physics, July 1973, American Institute of Physics

     Professor Frank Weinhold

137. 
     Lower Bounds to Expectation Values: Two-Electron Atoms

     Article • Canadian Journal of Chemistry, January 1973, Canadian Science Publishing

     Professor Frank Weinhold

138. 
     Variational Wavefunctions for H2+

     Article • The Journal of Chemical Physics, April 1972, American Institute of Physics

     Professor Frank Weinhold

139. 
     Upper and Lower Bounds to Quantum-Mechanical Properties

     Article • January 1972, Elsevier

     Professor Frank Weinhold

140. 
     Calculation of Upper and Lower Bounds to Oscillator Strengths

     Article • The Journal of Chemical Physics, March 1971, American Institute of Physics

     Professor Frank Weinhold

141. 
     Dickinson Energy of H2+

     Article • The Journal of Chemical Physics, January 1971, American Institute of Physics

     Professor Frank Weinhold

142. 
     Variational Upper and Lower Bounds to Dipole Transition Moments

     Article • Physical Review Letters, October 1970, American Physical Society (APS)

     Professor Frank Weinhold

143. 
     Criteria of Accuracy of Approximate Wavefunctions

     Article • Journal of Mathematical Physics, July 1970, American Institute of Physics

     Professor Frank Weinhold

144. 
     Variational Extensions of Lower Bounds to Expectation Values

     Article • January 1970, American Physical Society (APS)

     Professor Frank Weinhold

145. 
     Remark on lower bounds to eigenvalues

     Article • International Journal of Quantum Chemistry, September 1969, Wiley

     Professor Frank Weinhold

146. 
     New Formulas for Lower Bounds to Expectation Values

     Article • Physical Review (Series I), July 1969, American Physical Society (APS)

     Professor Frank Weinhold

147. 
     Inequalities for Multipole Dispersion Interactions

     Article • The Journal of Chemical Physics, May 1969, American Institute of Physics

     Professor Frank Weinhold

148. 
     Remark on lower bounds to eigenvalues

     Article • International Journal of Quantum Chemistry, May 1969, Wiley

     Professor Frank Weinhold

149. 
     Reduced Density Matrices of Atoms and Molecules. II. On the N‐Representability Problem

     Article • The Journal of Chemical Physics, October 1967, American Institute of Physics

     Professor Frank Weinhold

150. 
     Reduced Density Matrices of Atoms and Molecules. I. The 2 Matrix of Double‐Occupancy, Configuration‐Interaction Wavefunctions for Singlet States

     Article • The Journal of Chemical Physics, April 1967, American Institute of Physics

     Professor Frank Weinhold

151. 
     Improved Lower Bounds to the Overlap Integral of an Approximate Wavefunction with the True Wavefunction

     Article • The Journal of Chemical Physics, March 1967, American Institute of Physics

     Professor Frank Weinhold