Method of local‐scaling transformations and density functional theory in quantum chemistry. II. The procedure for reproducing a many‐electron wave function from x‐ray diffraction data on one‐electron density
- 19 October 1987
- journal article
- Published by Wiley in International Journal of Quantum Chemistry
- Vol. 32 (4) , 467-472
- https://doi.org/10.1002/qua.560320407
Abstract
No abstract availableKeywords
This publication has 28 references indexed in Scilit:
- Numerical applications of a quantum model for the coherent diffraction experimentActa Crystallographica Section A, 1982
- Idempotent density matrices for correlated systems from x-ray-diffraction structure factorsPhysical Review B, 1981
- Structural homeomorphism between the electronic charge density and the nuclear potential of a molecular systemPhysical Review A, 1980
- Notes on density matrix model for coherent x‐ray diffractionInternational Journal of Quantum Chemistry, 1978
- Interpretation of Experimental Charge Densities. The study of chemical bondingPhysica Scripta, 1977
- Charge density study of diamondThe Journal of Chemical Physics, 1973
- Analysis of diborane X-ray diffraction data utilizing structure factors calculated from molecular wave functionsActa Crystallographica Section A, 1970
- Electron Population Parameters from Least-Squares Refinement of X-ray Diffraction DataScience, 1970
- Structure of Fermion Density MatricesReviews of Modern Physics, 1963
- Some Recent Advances in Density Matrix TheoryReviews of Modern Physics, 1960