Elsevier Science CPC Program Library
Computer programs in physics and physical chemistry



1. Astronomy and Astrophysics

1.3 Radiative Transfer

ADMH MC3D (Fortran, 61382 lines).
Accelerated self-consistent radiative transfer based on the Monte-Carlo method. S. Wolf, Th. Henning. Distribution format: tar gzip file. 132(2000)166

1.8 Interstellar Medium

ADNZ PopRatio (Fortran, 37953 lines).
PopRatio: a program to calculate atomic level populations in astrophysical plasmas. A.I. Silva, S.M. Viegas. Distribution format: tar gzip file. 136(2001)319

2. Atomic Physics

2.1 Structure and Properties

ADNA RCFP (Fortran, 9192 lines).
Calculation of reduced coefficients and matrix elements in jj-coupling. G. Gaigalas, S. Fritzsche. Distribution format: tar gzip file. 134(2001)86
ADOK DFRATOM (Fortran, 3239 lines).
An atomic Dirac-Fock-Roothaan program. O. Matsuoka, Y. Watanabe. Distribution format: gzip file. 139(2001)218
ADOO ANCO (Fortran, 14800 lines).
Program to calculate pure angular momentum coefficients in jj-coupling. G. Gaigalas, S. Fritzsche, I.P. Grant. Distribution format: tar gzip file. 139(2001)263

2.7 Wave Functions and Integrals

ADMW MTRXCOUL (Fortran, 2749 lines).
A Fortran program to calculate the matrix elements of the Coulomb interaction involving hydrogenic wave functions. L. Sarkadi. Distribution format: gzip file. 133(2000)119

3. Biology and Molecular Biology

ADNW CA3D (Fortran, 2085 lines, Supplementary material).
CA3D: a Monte Carlo code to simulate 3D buffered diffusion of ions in sub- membrane domains. A. Gil, J. Segura. Distribution format: tar gzip file. 136(2001)269
ADOJ SMMP (Fortran, 15804 lines).
[SMMP] a modern package for simulation of proteins. F. Eisenmenger, U.H.E. Hansmann, S. Hayryan, C.-K. Hu. Distribution format: tar gzip file. 138(2001)192

4. Computational Methods

4.1 Angular Momentum Coupling Coefficients

ADNM RACAH (Maple V Release 4 and 5, 21742 lines ).
Maple procedures for the coupling of angular momenta. III. Standard quantities for evaluating many-particle matrix elements. G. Gaigalas, S. Fritzsche, B. Fricke. Other versions: ADFV, 103(1997)51, ADHW, 111(1998)167. Distribution format: gzip file. 135(2001)219
ADOR RACAH (Maple V, Releases 3, 4, and 5, 21760 lines).
Maple procedures for the coupling of angular momenta. IV. Spherical harmonics. T. Inghoff, S. Fritzsche, B. Fricke. Other versions: ADFV, 103(1997)51, ADHW, 111(1998)167. Distribution format: tar gzip file. 139(2001)297
ADOS RACAH (Maple V, Releases 3, 4, and 5, 21760 lines).
Maple procedures for the coupling of angular momenta. V. Recoupling coefficients. S. Fritzsche, T. Inghoff, T. Bastug, M. Tomaselli. Other versions: ADFV, 103(1997)51, ADHW, 111(1998)167. Distribution format: tar gzip file. 139(2001)314

4.2 Other Algebras and Groups

ADNT SigmaVector10D.m (Mathematica, 569 lines).
Irreducible decompositon of products of 10D chiral sigma matrices. S.J. Gates Jr, B. Radak, V.G.J. Rodgers. Distribution format: gzip file. 136(2001)173
ADOE jacobi2.0 (Mathematica, 2228 lines).
Symbolic test of the Jacobi identity for given generalized 'Poisson' bracket. M. Kroger, M. Hutter, H.C. Ottinger. Distribution format: tar gzip file. 137(2001)325

4.7 Other Functions

ADMP cuspint (Fortran, 9880 lines).
An adaptive contour code for the numerical evaluation of the oscillatory cuspoid canonical integrals and their derivatives. N.P. Kirk, J.N.L. Connor, C.A. Hobbs. Distribution format: tar gzip file. 132(2000)142
ADNX GFD_D3 (Fortran, 1274 lines).
Generalized Fermi-Dirac functions and derivatives: properties and evaluation. Z. Gong, L. Zejda, W. Dappen, J.M. Aparicio. Distribution format: tar gzip file. 136(2001)294
ADOH DTORH3 v 2.0 (Fortran, 1691 lines).
DTORH3 2.0: a new version of a computer program for the evaluation of toroidal harmonics. A. Gil, J. Segura. Other version: ADKV, 124(2000)104. Distribution format: tar gzip file. 139(2001)186

4.8 Linear Equations and Matrices

ADOP HQRII1 (Fortran, 7841 lines).
Fast eigensolver for dense real-symmetric matrices. C.F. Bunge. Distribution format: gzip file. 138(2001)92

4.9 Minimization and Fitting

ADOA DARWIN (Fortran, 1039 lines).
DARWIN: an evolutionary program for nonlinear modeling of chaotic time series. A. Alvarez, A. Orfila, J. Tintore. Distribution format: tar gzip file. 136(2001)334
ADOQ GENEREG (Fortran, 13816 lines).
A generalized regularization method for nonlinear ill-posed problems enhanced for nonlinear regularization terms. T. Roths, M. Marth, J. Weese, J. Honerkamp. Other versions: ACGH, 69(1992)99, ACPF, 77(1993)429. Distribution format: tar gzip file. 139(2001)279

4.12 Other Numerical Methods

ADOA DARWIN (Fortran, 1039 lines).
DARWIN: an evolutionary program for nonlinear modeling of chaotic time series. A. Alvarez, A. Orfila, J. Tintore. Distribution format: tar gzip file. 136(2001)334

4.14 Utility

ADOG Aranea (Java, 168822 lines).
ARANEA, a program for generating unstructured triangular meshes with a JAVA Graphics User Interface. R. Marchand, M. Charbonneau-Lefort, M. Dumberry, B. Pronovost. Distribution format: jar gzip file. 139(2001)172

5. Computer Algebra

ADNM RACAH (Maple V Release 4 and 5, 21742 lines ).
Maple procedures for the coupling of angular momenta. III. Standard quantities for evaluating many-particle matrix elements. G. Gaigalas, S. Fritzsche, B. Fricke. Other versions: ADFV, 103(1997)51, ADHW, 111(1998)167. Distribution format: gzip file. 135(2001)219
ADOE jacobi2.0 (Mathematica, 2228 lines).
Symbolic test of the Jacobi identity for given generalized 'Poisson' bracket. M. Kroger, M. Hutter, H.C. Ottinger. Distribution format: tar gzip file. 137(2001)325
ADOI DiffElim (C, 131674 lines).
Fast differential elimination in C: the CDiffElim environment. A.D. Wittkopf, G.J. Reid. Distribution format: tar gzip file. 139(2001)192

7. Condensed Matter and Surface Science

7.1 Defects

ADOD GFCUBHEX (Fortran, 1081 lines).
GFCUBHEX: program to calculate elastic Green's functions and displacement fields for applications in atomistic simulations of defects in cubic and HCP crystals. S.I. Golubov, X. Liu, H. Huang, C.H. Woo. Distribution format: tar gzip file. 137(2001)312

7.2 Electron Spectroscopies

ADMR MSPHD (Fortran, 11640 lines).
MSPHD: a full multiple scattering code for low energy photoelectron diffraction. R. Gunnella, F. Solal, D. Sebilleau, C.R. Natoli. Distribution format: tar gzip file. 132(2000)251
ADNI TensErLEED (Fortran, 22538 lines).
Fast LEED intensity calculations for surface crystallography using Tensor LEED. V. Blum, K. Heinz. Distribution format: tar gzip file. 134(2001)392
ADOT TMAT (Fortran, 2746 lines).
Anisotropic and anharmonic effects through the t-matrix for Low-Energy Electron Diffraction (TMAT V1.1). P.L. de Andres, D.A. King. Distribution format: gzip file. 138(2001)281

7.3 Electronic Structure

ADMZ Lanthanide (C, 19644 lines).
An atomic program for energy levels of equivalent electrons: lanthanides and actinides. S. Edvardsson, D. Aberg. Distribution format: tar gzip file. 133(2001)396
ADNQ genproj (Fortran, 69966 lines).
A projector augmented wave (PAW) code for electronic structure calculations, part I: atompaw for generating atom-centered functions. N.A.W. Holzwarth, A.R. Tackett, G.E. Matthews. Distribution format: tar gzip file. 135(2001)329
ADNP pwpaw (Fortran, 885380 lines).
A projector augmented wave (PAW) code for electronic structure calculations, part II: pwpaw for periodic solids in a plane wave basis. A.R. Tackett, N.A.W. Holzwarth, G.E. Matthews. Distribution format: tar gzip file. 135(2001)348

7.6 Neutron Scattering

ADNF FLAC (Fortran, 25403 lines).
Small angle scattering data analysis for dense polydisperse systems: the FLAC program. F. Carsughi, A. Giacometti, D. Gazzillo. Distribution format: tar gzip file. 133(2000)66

7.8 Structure and Lattice Dynamics

ADON SGROUP (C, 23319 lines).
Determination of the space group and unit cell for a periodic solid. B.Z. Yanchitsky, A.N. Timoshevskii. Distribution format: tar gzip file. 139(2001)235

7.10 Collisions in Solids

ADOF ERWP (Fortran, 3493 lines).
Quantum wave packet approach to the Eley-Rideal reactive scattering between a gas phase atom and an adsorbate. D. Lemoine, B. Jackson. Distribution format: tar gzip file. 137(2001)415

8. Crystallography

ADNI TensErLEED (Fortran, 22538 lines).
Fast LEED intensity calculations for surface crystallography using Tensor LEED. V. Blum, K. Heinz. Distribution format: tar gzip file. 134(2001)392
ADNU QCDiffractor (Mathematica, 121 lines).
A computer program written in Mathematica for calculating H2 quasicrystals and their diffraction patterns. R. Grodzicky. Distribution format: gzip file. 136(2001)236

10. Electrostatics and Electromagnetics

ADMQ MULTEM, version 2 (Fortran, 4545 lines).
MULTEM 2: a new version of the program for transmission and band- structure calculations of photonic crystals. N. Stefanou, V. Yannopapas, A. Modinos. Other version: ADIM, 113(1998)49. Distribution format: gzip file. 132(2000)189

11. Elementary Particle Physics

11.2 Phase Space and Event Simulation

ADMV JetViP version 2.1 (Fortran, 23309 lines).
JetViP 2.1: The hbook version. B. Potter. Other version: ADKC, 119(1999)45. Distribution format: tar gzip file. 133(2000)105
ADLJ 000ACORRECTION 08/2000 (Fortran). 133(2000)136
ADNE APACIC++, version 1.0 (C++, Fortran, 29710 lines).
APACIC++ 1.0, A parton cascade in C++. R. Kuhn, F. Krauss, B. Ivanyi, G. Soff. Distribution format: tar gzip file. 134(2001)223
ADNN PYTHIA V6.154 (Fortran, 52815 lines).
High-energy-physics event generation with PYTHIA 6.1. T. Sjostrand, P. Eden, C. Friberg, L. Lonnblad, G. Miu, S. Mrenna, E. Norrbin. Other version: ACTU, 82(1994)74. Distribution format: gzip file. 135(2001)238

11.4 Quantum Electrodynamics

ADNV GRCNuNuGamma (Fortran, 72641 lines).
Grcnunugamma: event generator for the single- and double-photon emission associated with neutrino pair-production. Y. Kurihara, J. Fujimoto, T. Ishikawa, Y. Shimizu, T. Munehisa. Distribution format: tar gzip file. 136(2001)250

11.5 Quantum Chromodynamics, Lattice Gauge Theory

ADMI QCDINS 2.0 (Fortran, 33308 lines).
QCDINS 2.0 - A Monte Carlo generator for instanton-induced processes in deep-inelastic scattering. A. Ringwald, F. Schrempp. Subroutines required: ACBY, 67(1992)465, ACTU, 82(1994)74. Distribution format: tar gzip file. 132(2000)267
ADMS HELAC (Fortran, 65726 lines).
HELAC: a package to compute electroweak helicity amplitudes. A. Kanaki, C.G. Papadopoulos. Distribution format: tar gzip file. 132(2000)306
ADMT RunDec (Mathematica, 1929 lines).
RunDec: a Mathematica package for running and decoupling of the strong coupling and quark masses. K.G. Chetyrkin, J.H. Kuhn, M. Steinhauser. Distribution format: tar gzip file. 133(2000)43
ADMU ANCONT v1.0 (Fortran, 6696 lines).
Analytic continuation of Mellin transforms up to two-loop order. J. Blumlein. Distribution format: gzip file. 133(2000)76
ADMJ ZFITTER version 6.21 (Fortran, 23893 lines)
ZFITTER v6.21, a semi-analytical program for fermion pair production in e+e- annihilation. D. Bardin, M. Bilenky, P. Christova, M. Jack, L. Kalinovskaya, A. Olchevski, S. Riemann, T. Riemann. Distribution format: tar gzip file. 133(2001)229
ADNG MATAD (FORM, 17497 lines).
MATAD: a program package for the computation of MAssive TADpoles. M. Steinhauser. Distribution format: tar gzip file. 134(2001)335
ADNO phi3 (Fortran, 1554 lines).
Nonperturbative evaluation of the few-body states for scalar chi-square phi interaction. C. Savkli. Distribution format: tar gzip file. 135(2001)312
ADNR GRAPE-Dilepton (v1.1) (Fortran, 262390 lines).
GRAPE-Dilepton (version 1.1) a generator for dilepton production in ep collisions. T. Abe. Distribution format: tar gzip file. 136(2001)126
ADNS NEXTCALIBUR (Fortran, 11133 lines).
NEXTCALIBUR - a four-fermion generator for electron-positron collisions. F.A. Berends, C.G. Papadopoulos, R. Pittau. Distribution format: tar gzip file. 136(2001)148

11.7 Detector Design and Simulation

ADNC optics (Fortran, Tk/Tcl, 8343 lines).
optics: general-purpose scintillator light response simulation code. E. Frlez, B.K. Wright, D. Pocanic. Distribution format: tar gzip file. 134(2001)110

14. Graphics

ADOB DataScan (Java, 65256 lines).
DataScan: an extensible program for image analysis in Java. K.A. Ritley, M. Schlestein, H. Dosch. Distribution format: zip file. 137(2001)300

16. Molecular Physics and Physical Chemistry

16.1 Structure and Properties

ADNB GFIT4C (Fortran, 9078 lines).
Global fit of ab initio potential energy surfaces: II.1. Tetraatomic systems ABCD. A. Aguado, C. Tablero, M. Paniagua. Distribution format: tar gzip file. 134(2001)97

16.2 Spectra

ADNL AsyrotWin (C++, Fortran, 56047 lines).
AsyrotWin: a 32-bit Windows version of Asyrot, a program for the analysis of high resolution singlet-singlet band spectra of asymmetric tops. R.H. Judge, D.J. Clouthier. Other versions: ACDS, 38(1985)83, ABBA, 47(1987)361, ACPS, 79(1994)555. Distribution format: zip file. 135(2001)293

16.8 Rearrangement Collisions, Charge Transfer and Chemical Reactions

ADMX ABC (Fortran, 26083 lines).
ABC: a quantum reactive scattering program. D. Skouteris, J.F. Castillo, D.E. Manolopoulos. Distribution format: tar gzip file. 133(2000)128
ADOF ERWP (Fortran, 3493 lines).
Quantum wave packet approach to the Eley-Rideal reactive scattering between a gas phase atom and an adsorbate. D. Lemoine, B. Jackson. Distribution format: tar gzip file. 137(2001)415

16.10 Wave Functions and Integrals

ADNY dfauto (Maple V (version 5), Bourne Shell, Fortran, LaTeX, 1571 lines).
Automatic code generation in density functional theory. R. Strange, F.R. Manby, P.J. Knowles. Distribution format: gzip file. 136(2001)310

16.12 Chemical Kinetics

ADNH PLASMAKIN (Fortran, 14647 lines, Supplementary material).
PLASMAKIN: a chemical kinetics library for plasma physics modeling. N.R. Pinhao. Non-profit use licence required. Distribution format: tar gzip file. 135(2001)105

17. Nuclear Physics

17.5 Experimental Analysis - Particle Detection

ADNJ OMEGA (Fortran, 1027 lines).
OMEGA code: calculation of the geometrical parameters of detection systems. V.P. Likhachev, J.D.T. Arruda-Neto, M.N. Martins, F. Garcia, J. Mesa, O. Rodriguez, V.B. Shostak, I. Evseev, S.A. Paschuk, H.R. Schelin, V.V. Denyak. Distribution format: tar gzip file. 135(2001)190

17.15 Spectroscopy - Level Scheme

ADOC LINDEN (Fortran, 4139 lines).
LINDEN: code for level density calculations of deformed nuclei using Lipkin-Nogami projectors in the BCS approach. O. Rodriguez, F. Garcia, H. Dias, J. Mesa, J.D.T. Arruda-Neto, E. Garrote, F. Guzman. Other version: ADAI, 86(1995)129. Distribution format: tar gzip file. 137(2001)405

17.18 Coefficients of Fractional Parentage - SU(3)

ADOL exactU3clebsch (Macsyma 2.4 (pro), 2558 lines).
A Macsyma program for computing analytic Clebsch-Gordan coefficients of U(3) contained in SO(3). T. Draeger. Distribution format: tar gzip file. 139(2001)246

19. Plasma Physics

19.1 Atomic and Molecular Processes

ADNK CRMODEL (C++, 53344 lines).
CRModel: a general collisional radiative modeling code. A. Hartgers, J. van Dijk, J. Jonkers, J.A.M. van der Mullen. Distribution format: tar gzip file. 135(2001)199

19.8 Kinetic Models

ADNH PLASMAKIN (Fortran, 14647 lines, Supplementary material).
PLASMAKIN: a chemical kinetics library for plasma physics modeling. N.R. Pinhao. Non-profit use licence required. Distribution format: tar gzip file. 135(2001)105

21. Radiation

21.2 Radiative Transfer

ADMH MC3D (Fortran, 61382 lines).
Accelerated self-consistent radiative transfer based on the Monte-Carlo method. S. Wolf, Th. Henning. Distribution format: tar gzip file. 132(2000)166

23. Statistical Physics and Thermodynamics

ADOE jacobi2.0 (Mathematica, 2228 lines).
Symbolic test of the Jacobi identity for given generalized 'Poisson' bracket. M. Kroger, M. Hutter, H.C. Ottinger. Distribution format: tar gzip file. 137(2001)325