| 30. EXTHUC: Extended Hückel Theory Calculations |
| 64. EXTHUC: Extended Hückel Theory Calculations |
| 70. HÜCKEL: Diagonalization |
| 71. SCFCIO: Closed-Shell SCF-LCAO-MO |
| 72. SE18: Numerical Solution of Two-Dimensional Schrödinger Equation |
| 76. POPLE PI: Pople Pi-Electron Program |
| 77. SCFOPEN: Open-Shell SCF-LCAO-MO |
| 81. HMO-II: Hückel Molecular Orbital Theory |
| 110. OMEGAMO: Hückel Calculations in Which the Input Matrix Is Modified by Charge Densities and Bond Lengths |
| 124. UHFOCK: Unrestricted Hartree-Fock Program |
| 132. HÜCKEL: Hückel Diagonalization (Revised) |
| 143. LCAO-MO-SCF-CI: Program for Aromatic Systems |
| 167. PEP: Pi-Electron Program |
| 184. POLAHUC: Pi Polarizabilities of Non-Saturated Organic Molecules |
| 200. DEWARPI: SCF-LCAO-MO Calculations by Dewar's Pi- Electron Method |
| 246. MIEHM: Energy Weighted, Maximum Overlap Method |
| 278. SPUHF: Brickstock-Pople UHF Calculation with Harriman Spin Projection Treatment |
| 314. SCFMO: PPP-SCF Calculation with CI |
| 325. MCA: A General Program for Molecular Crystals Analysis |
| 340. PSI/77: A Program to Plot Valence Shell and STO- 3G Wavefunctions or Electron Densities in Two and Three Spatial Dimensions |
| 344. FORTICON8: Extended Hückel Calculations on Molecules Containing Fifty or Fewer Atoms Bearing s, s and p, and s, p and d Electrons |
| 358. Extended Hückel Calculation |
| 380. Extended Hückel Calculation (CDC Version) |
| 385. Interactive Hückel MO Program |
| 387. REX: Relativistically Parameterized Extended Hückel Program |
| 420. BTERM |
| 443. VESCF: Variable Electronegativity Self-Consistent Field |
| 468. QATREX: Relativistically Parameterized Extended Hückel Program Employing Quaternionic Algebra |
| 469. FORTICON8: Extended Hückel Calculations on Molecules Containing Fifty or Fewer Atoms Bearing s, s and p and s, p and d Electrons (CDC Version) |
| 479. POLYBOX: Simulation of Molecular Problems by Particles in One-Dimensional Arrays of Boxes, with Exact, Variational and Hückel Options |
| 517. FORTICON8: Extended Hückel Calculations of Molecules Containing Fifty or Fewer Atoms Bearing s, s and p and s, p and d electrons (VAX Version) |
| 545. FORTICON8: Extended Hückel Calculations (IBM 3090 Version) |
| 565. BOXTRAN: Solutions of the One-Dimensional Schrödinger Equation |
| 571. Extended Hückel Molecular, Crystal and Properties Package |
| 108. VIB: Numerical Solution of the One-Dimensional Radial Equation |
| 166. TDHF: Time-Dependent Hartree-Fock Calculations in the Pariser-Parr-Pople Model |
| 227. Atomic Partial Charges Using Del Re's Theory |
| 269. THERMO: Standard-State Thermodynamic Functions of Polyatomic Molecules from Spectroscopic Constants |
| 284. MOPLOT: A Computer Program for the Study of Electron Distribution |
| 286. ECEPP: Empirical Conformational Energy Program for Peptides |
| 310. MOPLOT: IBM Version |
| 313. MOMAP: A Subroutine for Producing Contour Maps of MO Amplitudes |
| 334. CONFI: FORTRAN IV Program for Non-Quantum Mechanical Computation of Approximate Minimum Energy Geometry, Geometry Optimization, and for Obtaining Geometries Subjected to External Constraints |
| 36l. UNICEPP: United Atom Conformational Energy Program for Peptides |
| 393. HAM/3: Molecular Orbital Calculations by the HAM/3 Method |
| 396. ELPO: Electrostatic Isopotential Maps and Interaction Energies from Localized Orbital Contributions |
| 397. RING: Closing a Cyclic Structure Exactly |
| 417. ENERFT: Energy Fitting Program |
| 454. ECEPP: Empirical Conformational Energy Program for Peptides |
| 465. XASW: Atomic X-a and Molecular Multiple Scattering X-a Electronic Structure Calculations (Version 2.0) |
| 546. PCILO3: Perturbative Configuration Interaction (Version 3) (IBM 3090 Version) |
| 558. ECEPP/2: Empirical Conformational Energy Program for Peptides (IBM 3090 Version) |
| 593. QCFF/PI-CFFTH: QCFF/PI Including Extension for the Computation of S°(T), CO(p,°)(T), [H°(T)-H°(0)]/T and [G°(T)-G°(0)]/T |
| 599. ANNEAL: A Simulated Annealing Program to Study Polypeptide Conformations |