Pub Date : 1987-08-01DOI: 10.1016/0167-7977(87)90019-0
J.-L. Desbiolles, J.-J. Droux, J. Rappaz, M. Rappaz
{"title":"Simulation of solidification of alloys by the finite element method","authors":"J.-L. Desbiolles, J.-J. Droux, J. Rappaz, M. Rappaz","doi":"10.1016/0167-7977(87)90019-0","DOIUrl":"10.1016/0167-7977(87)90019-0","url":null,"abstract":"","PeriodicalId":100318,"journal":{"name":"Computer Physics Reports","volume":"6 1","pages":"Pages 371-383"},"PeriodicalIF":0.0,"publicationDate":"1987-08-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0167-7977(87)90019-0","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"80373671","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1987-08-01DOI: 10.1016/0167-7977(87)90011-6
M.O. Bristeau, R. Glowinski, J. Periaux
{"title":"Numerical methods for the navier-stokes equations. Applications to the simulation of compressible and incompressible viscous flows","authors":"M.O. Bristeau, R. Glowinski, J. Periaux","doi":"10.1016/0167-7977(87)90011-6","DOIUrl":"10.1016/0167-7977(87)90011-6","url":null,"abstract":"","PeriodicalId":100318,"journal":{"name":"Computer Physics Reports","volume":"6 1","pages":"Pages 73-187"},"PeriodicalIF":0.0,"publicationDate":"1987-08-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0167-7977(87)90011-6","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"84182654","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1987-07-01DOI: 10.1016/0167-7977(87)90006-2
W.M. Temmerman, Z. Szotek
{"title":"Calculating the electronic structure of random alloys with the KKR-CPA method","authors":"W.M. Temmerman, Z. Szotek","doi":"10.1016/0167-7977(87)90006-2","DOIUrl":"10.1016/0167-7977(87)90006-2","url":null,"abstract":"","PeriodicalId":100318,"journal":{"name":"Computer Physics Reports","volume":"5 4","pages":"Pages 173-220"},"PeriodicalIF":0.0,"publicationDate":"1987-07-01","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0167-7977(87)90006-2","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"89703659","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
Pub Date : 1986-12-02DOI: 10.1016/0167-7977(86)90006-7
S. Carter, N.C. Handy
In this paper the current status of the variational method for the determination of the rotational-vibrational energy levels of polyatomic systems is reviewed. Special attention is made for the derivation of the kinetic energy operator in various coordinate systems, and several forms are given. Similarly, analytic forms which are in current use for the potentials are given. The calculation of the Hamiltonian matrix elements (expansion functions, numerical integration grid points and weights) is described in detail, and a description of our programs for this problem is given in section 6.
{"title":"The variational method for the calculation of RO-vibrational energy levels","authors":"S. Carter, N.C. Handy","doi":"10.1016/0167-7977(86)90006-7","DOIUrl":"10.1016/0167-7977(86)90006-7","url":null,"abstract":"<div><p>In this paper the current status of the variational method for the determination of the rotational-vibrational energy levels of polyatomic systems is reviewed. Special attention is made for the derivation of the kinetic energy operator in various coordinate systems, and several forms are given. Similarly, analytic forms which are in current use for the potentials are given. The calculation of the Hamiltonian matrix elements (expansion functions, numerical integration grid points and weights) is described in detail, and a description of our programs for this problem is given in section 6.</p></div>","PeriodicalId":100318,"journal":{"name":"Computer Physics Reports","volume":"5 3","pages":"Pages 117-171"},"PeriodicalIF":0.0,"publicationDate":"1986-12-02","publicationTypes":"Journal Article","fieldsOfStudy":null,"isOpenAccess":false,"openAccessPdf":"https://sci-hub-pdf.com/10.1016/0167-7977(86)90006-7","citationCount":null,"resultStr":null,"platform":"Semanticscholar","paperid":"85496665","PeriodicalName":null,"FirstCategoryId":null,"ListUrlMain":null,"RegionNum":0,"RegionCategory":"","ArticlePicture":[],"TitleCN":null,"AbstractTextCN":null,"PMCID":"","EPubDate":null,"PubModel":null,"JCR":null,"JCRName":null,"Score":null,"Total":0}
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