J. G. Angyan
0000-0002-1986-5288
109 papers found
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Analytical 1st and 2nd Energy Derivatives in the Polarization Model
Generalized Self-Consistent Reaction Field-Theory in a Multicenter-Multipole Abinitio Lcgo Framework .1. Electronic-Properties of the Water Molecule in a Monte-Carlo Sample of Liquid Water-Molecules Studied With Standard Basis-Sets
Modeling the Electric-Field of Water Obtained From Accurate Scf Wave-Functions
Calculations on electrostatic properties of HY zeolite
Chiroptical Properties and Conformation of 4,5-Saturated Derivatives of 5-Aryl-1,4-benzodiazepin-2-ones
Intramolecular sulfur-oxygen interaction in sulfonium compounds and sulfoxides
Pcmep - Program for the Calculation of Molecular Electrostatic Potentials on the Ibm Pc-Xt Microcomputer
Bond Orders in 3-Center Bonds .2. The Role of D-Orbital Participation in Sulfuranes and Related Systems
Perturbation theory for nonlinear time-independent Schrödinger equations
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