Research Keywords
Paper Recommendation
1970 Relativistic Calculation Of Anomalous Scattering Factors For X Rays

1976 Two‐dimensional Spectroscopy. Application To Nuclear Magnetic Resonance

1955 Electronic Population Analysis On LCAO–MO Molecular Wave Functions. I

1933 A Theory Of Water And Ionic Solution, With Particular Reference To Hydrogen And Hydroxyl Ions

1944 Note On Becker's Theory Of The Shock Front

1969 Self‐Consistent Molecular‐Orbital Methods. I. Use Of Gaussian Expansions Of Slater‐Type Atomic Orbitals

1970 Raman Spectrum Of Graphite

1933 The Calculation Of Matrix Elements For Lewis Electronic Structures Of Molecules

1946 The Statistical Mechanical Theory Of Transport Processes I. General Theory

1953 Equation Of State Calculations By Fast Computing Machines

1971 Self‐Consistent Molecular‐Orbital Methods. IX. An Extended Gaussian‐Type Basis For Molecular‐Orbital Studies Of Organic Molecules

1972 Self—Consistent Molecular Orbital Methods. XII. Further Extensions Of Gaussian—Type Basis Sets For Use In Molecular Orbital Studies Of Organic Molecules

1974 Improved Simulation Of Liquid Water By Molecular Dynamics

1970 Gaussian Basis Set For Molecular Wavefunctions Containing Third‐Row Atoms

1933 Chemical Aspects Of The Infrared Absorption Spectra Of The Ethyl Halides

1947 Physical Properties And Cation Arrangement Of Oxides With Spinel Structures I. Cation Arrangement In Spinels

1933 Dispersion And Polarizability And The Van Der Waals Potential In The Alkali Halides

1934 A Relation Between Internuclear Distances And Bond Force Constants

1993 Density‐functional Thermochemistry. III. The Role Of Exact Exchange

1966 Conformational Analysis Of Macromolecules. III. Helical Structures Of Polyglycine And Poly‐L‐Alanine