BISON: A FORTRAN COMPUTER SYSTEM FOR THE CALCULATION OF ANALYTIC SELF- CONSISTENT-FIELD WAVEFUNCTIONS, PROPERTIES, AND CHARGE DENSITIES FOR DIATOMIC MOLECULES. PART 1. USER'S MANUAL AND GENERAL PROGRAM DESCRIPTION.
- Research Organization:
- Argonne National Lab., Ill.
- DOE Contract Number:
- W-31-109-ENG-38
- NSA Number:
- NSA-23-001561
- OSTI ID:
- 4838883
- Report Number(s):
- ANL-7271
- Resource Relation:
- Other Information: UNCL. Orig. Receipt Date: 31-DEC-69
- Country of Publication:
- United States
- Language:
- English
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BISON-MC: A FORTRAN COMPUTING SYSTEM FOR MULTICONFIGURATION SELF- CONSISTENT-FIELD (MCSCF) CALCULATIONS ON ATOMS, DIATOMS, AND POLYATOMS.
ANALYTIC SELF-CONSISTENT FIELD WAVE FUNCTIONS AND COMPUTER PROPERTIES FOR HOMONUCLEAR DIATOMIC MOLECULES
All-electron relativistic Dirac-Fock-Slater self-consistent-field calculations of the singly charged diatomic transition-metal- (Fe, Co, Ni, Cu, Zn) argon molecules
Technical Report
·
Sat Jan 01 00:00:00 EST 1972
·
OSTI ID:4838883
ANALYTIC SELF-CONSISTENT FIELD WAVE FUNCTIONS AND COMPUTER PROPERTIES FOR HOMONUCLEAR DIATOMIC MOLECULES
Technical Report
·
Sat Aug 01 00:00:00 EDT 1964
·
OSTI ID:4838883
All-electron relativistic Dirac-Fock-Slater self-consistent-field calculations of the singly charged diatomic transition-metal- (Fe, Co, Ni, Cu, Zn) argon molecules
Journal Article
·
Sun Oct 01 00:00:00 EDT 1995
· Physical Review A
·
OSTI ID:4838883
+2 more
Related Subjects
N33240* -Physics (Theoretical)-Mathematical Physics
ATOMIC MODELS
B-CODES
COMPUTERS
ENERGY LEVELS
EQUATIONS
HARTREE- FOCK METHOD
MOLECULES
PROGRAMMING
QUANTUM MECHANICS
SELF-CONSISTENT FIELD
COMPUTER PROGRAMS/BISON, for calculating analytic self- consistent-field wave functions, properties, and charge densities for diatomic molecules, in FORTRAN for CDC-3600 or IBM 360/75
MOLECULES/properties of diatomic
computer program for calculating quantum
ATOMIC MODELS
B-CODES
COMPUTERS
ENERGY LEVELS
EQUATIONS
HARTREE- FOCK METHOD
MOLECULES
PROGRAMMING
QUANTUM MECHANICS
SELF-CONSISTENT FIELD
COMPUTER PROGRAMS/BISON, for calculating analytic self- consistent-field wave functions, properties, and charge densities for diatomic molecules, in FORTRAN for CDC-3600 or IBM 360/75
MOLECULES/properties of diatomic
computer program for calculating quantum