화학공학소재연구정보센터
검색결과 : 11건
No. Article
1 Multicenter integrals of spherical Laguerre Gaussian orbitals by generalized spherical gradient operators
Chiu LYC, Moharerrzadeh M
Journal of Chemical Physics, 108(13), 5230, 1998
2 Properties of electron density and other one-electron observables derived from generalized Hiller-Sucher-Feinberg identities
Cioslowski J, Lopez-Boada R
Journal of Chemical Physics, 109(4), 1230, 1998
3 Convergence analysis of the addition theorem of Slater orbitals and its application to three-center nuclear attraction integrals
Bouferguene A, Jones HW
Journal of Chemical Physics, 109(14), 5718, 1998
4 A multipole acceptability criterion for electronic structure theory
Schwegler E, Challacombe M, Head-Gordon M
Journal of Chemical Physics, 109(20), 8764, 1998
5 A Tensor Approach to 2-Electron Matrix-Elements
Adams TR, Adamson RD, Gill PM
Journal of Chemical Physics, 107(1), 124, 1997
6 New Operators for Electronic Density Calculation .1. Derivations and Formal Analysis
Rassolov VA, Chipman DM
Journal of Chemical Physics, 105(4), 1470, 1996
7 On the Vacuum-Ultraviolet Radical Photolysis CH2(1(3)B(1))+h-Nu-)CH(A(2)Delta)+h(1(2)S) - A Combined Experimental and Theoretical Investigation
Kassner C, Stuhl F, Luo M, Lehner M, Fink R, Jungen M
Journal of Chemical Physics, 105(11), 4605, 1996
8 Gauge-Invariant Basis-Sets for Magnetic Property Calculations
Sugimoto M, Nakatsuji H
Journal of Chemical Physics, 102(1), 285, 1995
9 Numerical Multiconfigurational Hartree-Fock Calculations of Spin and Charge-Densities Using the Hiller-Sucher-Feinberg Operator Identity
Sundholm D
Journal of Chemical Physics, 102(12), 4895, 1995
10 Spin-Density in First-Row Diatomic Hydrides from the Hiller-Sucher-Feinberg Identity
Rassolov VA, Chipman DM
Journal of Chemical Physics, 103(23), 10058, 1995