TY  - BOOK
AU  - Rogers,Donald
TI  - Computational chemistry using the PC
SN  - 1560816724
AV  - QD39.3.E46 R64 1994
PY  - 1994///]
CY  - New York, N.Y.
PB  - VCH
KW  - Chemistry
KW  - Data processing
KW  - Mathematics
N1  - Includes bibliographical references and index; 1.Iterative Methods; 2. Numerical Integration; 3. Matrices; 4. Linear Nonhomogeneous Simultaneous Equations; 5. Curve Fitting; 6. Multivariate Least Squares Analysis; 7. Molecular Orbital Calculations: Eigenvalues; 8. Molecular Orbital Calculations: Eigenvectors; 9. Self-Consistent Field Theory; 10. Molecular Mechanics; 11. Elements of Computer Graphics; 12. Molecular Quantum Mechanics: The ab Initio Method; 13. Advanced Semiempirical Molecular Orbital Theory: MNDO, AM1, and PM3; Appendix A: Listing of Programs and Sources; Index
ER  -