@article{oai:toyama.repo.nii.ac.jp:00003967, author = {永原, 茂 and 沢井, 喜作}, issue = {1/2}, journal = {富山大学工学部紀要}, month = {Mar}, note = {If one attacks the quantum mechanical problems of molecular structure by an expansion of the wave function's in terms of AO's (atomic orbitals), then the differential equation's are reduced to matrix equations and the difficulties conceutrate to a large extent in the evaluation of the integrals in terms of which the matrix element are defined. If we use Slater type AO's, then all the integrals, in volving only two centers can be obtained in closed analytical form (except for one tyne, two-center exchange integrals). These two-center integrals are then only ones, occurring in diatomic molecules, and also the most important one occurring in polyatomic molecules. We obtained the programs of the awxiliary functions in molecular integrals by Algol's expression which are used in the electronic computer of FACOM 202 (the Institute of Sobid State Physics, Jokyo University)., 分子積分を求めるに色々の方法があるがここでは小谷方法に準拠して求めた。 そして,まず分子積分に必要な補助亟数の計算をALGOLによるプログラムでつくった。, Article, 富山大学工学部紀要,17(1/2)}, pages = {122--130}, title = {分子積分に関するプログラミングの研究 I}, volume = {17}, year = {1966} }