화학공학소재연구정보센터
검색결과 : 5건
No. Article
1 Molecular Exchange-Correlation Kohn-SHAM Potential and Energy Density from Ab-Initio First-Order and 2nd-Order Density-Matrices - Examples for Xh (X=li, B, F)
Gritsenko OV, Vanleeuwen R, Baerends EJ
Journal of Chemical Physics, 104(21), 8535, 1996
2 Improved Density-Functional Theory Results for Frequency-Dependent Polarizabilities, by the Use of an Exchange-Correlation Potential with Correct Asymptotic-Behavior
Vangisbergen SJ, Osinga VP, Gritsenko OV, Vanleeuwen R, Snijders JG, Baerends EJ
Journal of Chemical Physics, 105(8), 3142, 1996
3 Exact-Solutions of Regular Approximate Relativistic Wave-Equations for Hydrogen-Like Atoms
Vanleeuwen R, Vanlenthe E, Baerends EJ, Snijders JG
Journal of Chemical Physics, 101(2), 1272, 1994
4 Analysis of Electron Interaction and Atomic Shell Structure in Terms of Local Potentials
Gritsenko O, Vanleeuwen R, Baerends EJ
Journal of Chemical Physics, 101(10), 8955, 1994
5 Electrodeposited Defect Chemistry Superlattices
Switzer JA, Hung CJ, Breyfogle BE, Shumsky MG, Vanleeuwen R, Golden TD
Science, 264(5165), 1573, 1994