MRIA - A PROGRAM FOR A FULL PROFILE ANALYSIS OF POWDER MULTIPHASE NEUTRON-DIFFRACTION TIME-OF-FLIGHT (DIRECT AND FOURIER) SPECTRA

被引:409
作者
ZLOKAZOV, VB
CHERNYSHEV, VV
机构
[1] MV LOMONOSOV STATE UNIV,MOSCOW 119899,USSR
[2] JOINT INST NUCL RES,LCTA,MOSCOW 101000,USSR
关键词
D O I
10.1107/S0021889891013122
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
The paper describes a universal program MRIA for the full profile analysis of powder neutron-diffraction time-of-flight direct and Fourier spectra. The minimum configuration of MRIA, analysing up to four spectra, four phases, 500 Miller indices for every phase and 100 independent atoms, can run on an IBM PC-AT or any compatible. The extended variant of the program, analysing data of larger size, runs on a MicroVAX computer. Part of MRIA, providing necessary service functions for a PC user, is written in TurboPascal 6.0. The basic programs of MRIA are written in standard Fortran77 and can be compiled by RMFORT or MSFORT77 and by an NDP compiler on a 32 bit PC.
引用
收藏
页码:447 / 451
页数:5
相关论文
共 8 条
[1]  
ALEKSANDROW YA, 1981, DIFFRACTION METHODS
[2]   ON THE PROBLEM OF FE-SUBSTITUTION IN YBA2CU3O7-DELTA - A NEUTRON POWDER DIFFRACTION STUDY [J].
BALAGUROV, AM ;
PIECHOTA, J ;
PAJACZKOWSKA, A ;
MIRONOVA, GM ;
SZYMCZAK, H .
ZEITSCHRIFT FUR PHYSIK B-CONDENSED MATTER, 1989, 76 (02) :153-158
[3]  
BALAGUROV AM, 1984, JINR P384765 JOINT I
[4]  
BALAGUROV AM, 1990, SUPERCOND PHYS CHEM, V3, P615
[5]   EXPLOITATION OF THE FOURIER CHOPPER IN NEUTRON DIFFRACTOMETRY AT PULSED SOURCES [J].
HIISMAKI, P ;
POYRY, H ;
TITTA, A .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1988, 21 :349-354
[6]  
HIISMAKI P, 1987, 1985 P C NEUTR SCATT, P453
[7]   RIETVELD REFINEMENT WITH SPALLATION NEUTRON POWDER DIFFRACTION DATA [J].
VONDREELE, RB ;
JORGENSEN, JD ;
WINDSOR, CG .
JOURNAL OF APPLIED CRYSTALLOGRAPHY, 1982, 15 (DEC) :581-589
[8]   GFIT - GENERALIZED QUADRATIC APPROXIMATION OF FUNCTIONS UNDER CONSTRAINTS [J].
ZLOKAZOV, VB .
COMPUTER PHYSICS COMMUNICATIONS, 1989, 54 (2-3) :371-379