First and second-order properties of charge-localized and Frost-localized orbitals

[1]  R. J. Crispin,et al.  Second-order properties of bonds , 1973 .

[2]  J. L. Nelson,et al.  Local orbitals for bonding in ethane , 1973 .

[3]  W. Niessen,et al.  Density localization of atomic and molecular orbitals , 1973 .

[4]  David F. Brailsford,et al.  THE OPIT SYSTEM I. A FILE HANDLING SCHEME FOR DATA IN LARGE APPLICATIONS PROGRAMS , 1973 .

[5]  M. Gordon,et al.  Localized Charge Distributions. II. An Interpretation of the Barriers to Internal Rotation in H2O2 , 1972 .

[6]  M. Gordon,et al.  Localized Charge Distributions. III. Transferability and Trends of Carbon-Hydrogen Moments and Energies in Acyclic Hydrocarbons , 1972 .

[7]  M. Gordon,et al.  Localized Charge Distributions. I. General Theory, Energy Partitioning, and the Internal Rotation Barrier in Ethane , 1971 .

[8]  R. Pitzer,et al.  Minimum Basis Wavefunctions for Water , 1970 .

[9]  S. Rothenberg.  Localized Orbitals for Polyatomic Molecules. I. The Transferability of the C–H Bond in Saturated Molecules , 1969 .

[10]  R. H. Pritchard,et al.  Bond moments in the two-carbon series ethane, ethylene, and acetylene , 1969 .

[11]  R. Rouse,et al.  Floating spherical Gaussian orbital model of molecular structure. IV. Hydrocarbons , 1968 .

[12]  A. A. Frost.  Floating Spherical Gaussian Orbital Model of Molecular Structure. I. Computational Procedure. LiH as an Example , 1967 .

[13]  Joseph G. Hoffman,et al.  Quantum Theory of Atoms, Molecules and the Solid State: A Tribute to John C. Slater , 1967 .

[14]  R. Pitzer.  Optimized Molecular Orbital Wavefunctions for Methane Constructed from a Minimum Basis Set , 1967 .

[15]  W. Lipscomb,et al.  Molecular SCF Calculations on CH4, C2H2, C2H4, C2H6, BH3, B2H6, NH3, and HCN , 1966 .

[16]  W. Lipscomb,et al.  Calculation of the Barrier to Internal Rotation in Ethane , 1963 .

[17]  Klaus Ruedenberg,et al.  Localized Atomic and Molecular Orbitals , 1963 .

[18]  A. Duncan.  Electronic Structure of Ammonia , 1957 .

[19]  J. Linnett,et al.  Applications of a simple molecular wavefunction. Part 1.—Floating Spherical Gaussian Orbital calculations for propylene and propane , 1974 .

[20]  Harel Weinstein,et al.  Localized Molecular Orbitals , 1971 .

[21]  C. Coulson.  The dipole moment of the C—H bond , 1942 .