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abinit-6.0.4-alt1.qa1.i586.rpm

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توضیحات

Computational Chemistry DFT program
ویژگی مقدار
سیستم عامل Linux
توزیع ALT p8
مخزن ALTLinux classic i586
نام بسته abinit
نام فایل بسته abinit-6.0.4-alt1.qa1.i586.rpm
نسخه بسته 6.0.4
انتشار بسته alt1.qa1
معماری بسته i586
نگهدارنده -
تاریخ ساخت Wed 17 Apr 2013 10
هاست سازنده qa_ldv-sisyphus.hasher.altlinux.org
نوع بسته .rpm
آدرس صفحه اصلی http://www.abinit.org/
مجوز GPL
حجم دانلود 2.8M
حجم نصب 10.262M
ABINIT is a package whose main program allows one to find the total energy, charge density and electronic structure of systems made of electrons and nuclei (molecules and periodic solids) within Density Functional Theory (DFT), using pseudopotentials and a planewave basis. ABINIT also includes options to optimize the geometry according to the DFT forces and stresses, or to perform molecular dynamics simulations using these forces, or to generate dynamical matrices, Born effective charges, and dielectric tensors. Excited states can be computed within the Time-Dependent Density Functional Theory (for molecules), or within Many-Body Perturbation Theory (the GW approximation). In addition to the main ABINIT code, different utility programs are provided.


جایگزین ها

بسته نسخه معماری مخزن
abinit-6.0.4-alt1.qa1.x86_64.rpm 6.0.4 x86_64 ALT classic


نیازمندی

مقدار نام
- /bin/sh
- /lib/ld-linux.so.2
- libc.so.6(GLIBC_2.0)
- libc.so.6(GLIBC_2.4)
- libgcc_s.so.1(GCC_4.0.0)
>= set:nhI2FGgkEAYqRrK9glFZayjAteKybt22aHDqRqSPAIYTkggVLWmwn7skLsUAhvZpwViPrgjZ4KlwbOCtAGzZE9ti1F6MDXjIghQkGYKpkQiY4YbdmNvqEKPQDEivJVzb5qlcgH0x9VZ0l7EOZ0ZgrgGMXIqQ6NKk0 libgfortran.so.3
- rpmlib(SetVersions)
- libgfortran.so.3(GFORTRAN_1.0)
- libm.so.6(GLIBC_2.0)
- libm.so.6(GLIBC_2.1)
- rtld(GNU_HASH)
- rpmlib(PayloadIsLzma)


ارائه دهنده

مقدار نام
= 6.0.4-alt1.qa1 abinit


نحوه نصب


نصب پکیج rpm abinit:

    sudo apt-get install abinit-6.0.4-alt1.qa1.i586.rpm


فایل ها

مسیرها
/usr/bin/abinetcdf
/usr/bin/abinis
/usr/bin/aim
/usr/bin/anaddb
/usr/bin/band2eps
/usr/bin/conducti
/usr/bin/cut3d
/usr/bin/lwf
/usr/bin/macroave
/usr/bin/mrgddb
/usr/bin/mrggkk
/usr/bin/mrgscr
/usr/bin/newsp
/usr/bin/optic
/usr/share/doc/abinit-6.0.4
/usr/share/doc/abinit-6.0.4/features
/usr/share/doc/abinit-6.0.4/features/features_v2.3.htm
/usr/share/doc/abinit-6.0.4/features/features_v3.0.htm
/usr/share/doc/abinit-6.0.4/features/features_v3.1.htm
/usr/share/doc/abinit-6.0.4/features/features_v3.2.htm
/usr/share/doc/abinit-6.0.4/features/features_v3.3.htm
/usr/share/doc/abinit-6.0.4/features/features_v3.4.htm
/usr/share/doc/abinit-6.0.4/features/features_v4.0.htm
/usr/share/doc/abinit-6.0.4/features/features_v4.1.htm
/usr/share/doc/abinit-6.0.4/features/features_v4.2.htm
/usr/share/doc/abinit-6.0.4/features/features_v4.3.html
/usr/share/doc/abinit-6.0.4/features/features_v4.4.html
/usr/share/doc/abinit-6.0.4/features/features_v4.5.html
/usr/share/doc/abinit-6.0.4/features/features_v4.6.html
/usr/share/doc/abinit-6.0.4/features/features_v4.7.html
/usr/share/doc/abinit-6.0.4/features/features_v5.0.html
/usr/share/doc/abinit-6.0.4/features/features_v5.1.html
/usr/share/doc/abinit-6.0.4/features/features_v5.2.html
/usr/share/doc/abinit-6.0.4/features/features_v5.3.html
/usr/share/doc/abinit-6.0.4/features/features_v5.4.html
/usr/share/doc/abinit-6.0.4/features/features_v5.5.html
/usr/share/doc/abinit-6.0.4/features/features_v5.6.html
/usr/share/doc/abinit-6.0.4/features/features_v5.7.html
/usr/share/doc/abinit-6.0.4/features/features_v5.8.html
/usr/share/doc/abinit-6.0.4/features/features_v6.0.html
/usr/share/doc/abinit-6.0.4/tutorial
/usr/share/doc/abinit-6.0.4/tutorial/lesson_1
/usr/share/doc/abinit-6.0.4/tutorial/lesson_1.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_1/Plot1.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_1/dim.m
/usr/share/doc/abinit-6.0.4/tutorial/lesson_2.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_3.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_4.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/opendx_cp1.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/opendx_sequencer_control.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/opendx_view_control.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/opendx_vpe1.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/opendx_vpe2.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_analysis_tools/si_den_111.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_elastic.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_elphon.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_ffield
/usr/share/doc/abinit-6.0.4/tutorial/lesson_ffield.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_ffield/image004.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_ffield/image007.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_gw1.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_gw2.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_ldau.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/filelist.xml
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image001.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image002.pct
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image003.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image005.pct
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image006.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image008.pct
/usr/share/doc/abinit-6.0.4/tutorial/lesson_nlo/image009.gif
/usr/share/doc/abinit-6.0.4/tutorial/lesson_optic
/usr/share/doc/abinit-6.0.4/tutorial/lesson_optic.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_optic/toptic_ref_0001_0001-linopt.out
/usr/share/doc/abinit-6.0.4/tutorial/lesson_optic/toptic_ref_0001_0002_0003-ChiTotIm.out
/usr/share/doc/abinit-6.0.4/tutorial/lesson_optic/toptic_ref_0001_0002_0003-ChiTotRe.out
/usr/share/doc/abinit-6.0.4/tutorial/lesson_parallelism
/usr/share/doc/abinit-6.0.4/tutorial/lesson_parallelism.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_parallelism/lesson_parallelism_overhead.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_parallelism/lesson_parallelism_speedup.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1/DOS-2proj.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1/DOS-4proj.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1/DOS-6proj.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw1/etotal-acell.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/AtompawAbinit.tar.gz
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.atompaw.input.semicore
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.atompaw.input.vanderbilt
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.atompaw.input1
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.atompaw.input2
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.atompaw.input3
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/Ni.ghost.atompaw.input
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/RSO.png
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/RSOcompa.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/abinit.pawps.rrkj
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/acell-etotal.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/atompawUG.pdf
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/ecut.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log0a.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log0b.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log1a.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log1b.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log1c.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/log2a.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/wfn1a.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/wfn6a.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_paw2/wfn6b.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_rf1.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_rf2
/usr/share/doc/abinit-6.0.4/tutorial/lesson_rf2.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_rf2/trf2_6.out.eps
/usr/share/doc/abinit-6.0.4/tutorial/lesson_source_code.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin/bccfe_mag_dos2.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin/bccfe_nonmag_dos2.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin/energy_diff_fccfe.jpg
/usr/share/doc/abinit-6.0.4/tutorial/lesson_spin/gz2.py
/usr/share/doc/abinit-6.0.4/tutorial/lesson_tddft.html
/usr/share/doc/abinit-6.0.4/tutorial/lesson_visual.txt
/usr/share/doc/abinit-6.0.4/tutorial/lesson_wannier90.html
/usr/share/doc/abinit-6.0.4/tutorial/welcome.html
/usr/share/doc/abinit-6.0.4/users
/usr/share/doc/abinit-6.0.4/users/AbinitBandStructureMaker_manual.pdf
/usr/share/doc/abinit-6.0.4/users/AbinitBandStructureMaker_manual.tex
/usr/share/doc/abinit-6.0.4/users/FAQ.html
/usr/share/doc/abinit-6.0.4/users/How_to_use_LDA_plus_U.txt
/usr/share/doc/abinit-6.0.4/users/abinit_help.html
/usr/share/doc/abinit-6.0.4/users/acknowledgments.html
/usr/share/doc/abinit-6.0.4/users/aim_help.html
/usr/share/doc/abinit-6.0.4/users/aimhelp.pdf
/usr/share/doc/abinit-6.0.4/users/aimhelp.ps
/usr/share/doc/abinit-6.0.4/users/aimhelp.tex
/usr/share/doc/abinit-6.0.4/users/anaddb_help.html
/usr/share/doc/abinit-6.0.4/users/band2eps_help
/usr/share/doc/abinit-6.0.4/users/bibliography.html
/usr/share/doc/abinit-6.0.4/users/conducti_manual.pdf
/usr/share/doc/abinit-6.0.4/users/conducti_manual.tex
/usr/share/doc/abinit-6.0.4/users/conductivity_paw_manu.pdf
/usr/share/doc/abinit-6.0.4/users/conductivity_paw_manu.tex
/usr/share/doc/abinit-6.0.4/users/context.txt
/usr/share/doc/abinit-6.0.4/users/cut3d_help.html
/usr/share/doc/abinit-6.0.4/users/ddbs_upgrade.txt
/usr/share/doc/abinit-6.0.4/users/elphon_manual.pdf
/usr/share/doc/abinit-6.0.4/users/elphon_manual.tex
/usr/share/doc/abinit-6.0.4/users/formabinit.css
/usr/share/doc/abinit-6.0.4/users/linear_optics_paw.pdf
/usr/share/doc/abinit-6.0.4/users/linear_optics_paw.tex
/usr/share/doc/abinit-6.0.4/users/mrgddb_help.html
/usr/share/doc/abinit-6.0.4/users/netiquette.html
/usr/share/doc/abinit-6.0.4/users/new_user_guide.html
/usr/share/doc/abinit-6.0.4/users/newsp_help.txt
/usr/share/doc/abinit-6.0.4/users/optic_help.html
/usr/share/doc/abinit-6.0.4/users/other_codes.txt
/usr/share/doc/abinit-6.0.4/users/paral_use.txt
/usr/share/doc/abinit-6.0.4/users/piezoelectric.txt
/usr/share/doc/abinit-6.0.4/users/positronmanual.txt
/usr/share/doc/abinit-6.0.4/users/problem_report.txt
/usr/share/doc/abinit-6.0.4/users/respfn_help.html
/usr/share/doc/abinit-6.0.4/users/respfn_help.keep
/usr/share/doc/abinit-6.0.4/users/spacegrouphelpfile.html
/usr/share/doc/abinit-6.0.4/users/spgrcopyright.html
/usr/share/doc/abinit-6.0.4/users/spgrdefinition.html
/usr/share/doc/abinit-6.0.4/users/spgrdescription.html
/usr/share/doc/abinit-6.0.4/users/spgrhead.html
/usr/share/doc/abinit-6.0.4/users/tuning.txt
/usr/share/doc/abinit-6.0.4/users/users-docs.mk


گزارش تغییرات

تاریخ آخرین تغییر جزئیات
2013-04-17

NMU: rebuilt for debuginfo.

2010-06-01

6.0.4

2009-08-11

5.8.4

2009-01-10

5.6.4
spec cleanup

2006-07-10

Initial build