ARY 发表于 2025-3-28 14:57:18
Accurate Calculations and Calibration,ally feasible only for small systems, because of the rapid increase in computer time and perhaps storage requirements of the calculations with increasing size of the molecule. In many cases it is not even necessary to perform such calculations for the purposes of prediction or interpretation, since江湖骗子 发表于 2025-3-28 21:57:01
The Effective Core Potential Method, They replaced the full Fock-operator with the following operator:. where .. is a valence orbital energy and .. are the core orbital energies. The .:s in the projection operators are the core orbitals, and .. is the usual Fock-operator defined in the valence space only. It is easily realized that thBudget 发表于 2025-3-28 23:07:50
http://reply.papertrans.cn/59/5835/583410/583410_43.pngInordinate 发表于 2025-3-29 06:26:22
Human Rights Obligations of the ICTs under International Lawder international law at all. If so, these must stem from other sources of international law. This chapter therefore investigates whether the ICTs, as legal entities, are bound by general international human rights law. To that end, this chapter first addresses the legal status of the ICTs in intern