以下所列是科學界或市面上常見的第一原理和固態計算的軟體
ABINIT Free, GPL Fortran
ACES Free, GPL Fortran,?C++
AMPAC Academic Unknown
ADF Commercial Fortran
Atomistix ToolKit(ATK) CommercialC++,?Python
BigDFT Free, GPL Fortran
CADPAC Academic Fortran
CASINO?(QMC) Academic Fortran 95
CASTEP Academic (UK), commercial Fortran 95,?Fortran 2003
CFOUR Academic Fortran
COLUMBUS Academic Fortran
CONQUEST Academic Fortran 90
CP2K Free, GPL Fortran 95
CPMD Academic Fortran
Crystal Academic (UK), commercial Fortran
DACAPO Free,?GPL?1 Fortran
Dalton Academic Fortran
deMon2k Academic, commercial Fortran
DFTB+ Academic, commercial Fortran 95
DFT++ Free,?GPL C++
DIRAC Academic Fortran 77,?Fortran 90,?C
DMol3 Commercial Fortran 90
ELK Free,?GPL Fortran 95
Empire Academic, commercial Fortran
EPW6 Free,?GPL Fortran
ErgoSCF Free,?GPL C++
ERKALE Free,?GPL C++
EXCITING Free,?GPL Fortran 95
FLEUR Academic Fortran 95
FHI-aims Commercial Fortran
FPLO13 Commercial Fortran 95,?C++,?Perl
FreeON Free,?GPL Fortran 95
Firefly,?PC GAMESS Academic Fortran,?C,?Assembly
GAMESS (UK) Academic (UK), commercial Fortran
GAMESS (US) Academic Fortran
Gaussian Commercial Fortran
GPAW Free,?GPL Python,?C
HiLAPW Unknown Unknown
HORTON Free,?GPL Python,?C++
Jaguar Commercial Fortran,?C
JDFTx Free,?GPL C++,?CUDA
LOWDIN Academic Fortran 95, 03
MADNESS Free,?GPL C++
MISSTEP Free,?GPL C++
MOLCAS Academic, commercial[1] Fortran,?C,?C++,?Python,?Perl
MolDS Free,?GPL C++
MOLPRO Commercial Fortran
MONSTERGAUSS Free Fortran
MOPAC Academic, commercial Fortran
MPQC Free,?LGPL C++
NRLMOL Unknown Fortran
NTChem Unknown Unknown
NWChem Free,?ECL?v2 Fortran 77,?C
Octopus Free,?GPL Fortran 95,?C,?OpenCL
ONETEP Academic (UK), commercial Fortran
OpenAtom Academic Charm++?(C++)
OpenMX Free,?GPL C
ORCA Academic C++
PLATO Academic Unknown
PQS Commercial Unknown
Priroda-06 Academic C
PSI Free,?GPL C,?C++,?Python
PUPIL Free,?GPL Fortran,?C
PWmat Commercial Fortran
PWscf6 Free,?GPL Fortran
PyQuante Free,?BSD Python
PySCF Free,?BSD Python
Q-Chem Commercial Fortran,?C++
QMCPACK (QMC)Free,?U. Illinois Open Source C++,?CUDA
Quantemol-N Academic, commercial Fortran
QSite Unknown Unknown
Quantum ESPRESSO Free,?GPL Fortran
RMG Free,?GPL C,?C++
RSPt Academic Fortran,?C
Scigress Commercial C++,?C,?Java,?Fortran
Spartan Commercial Fortran, ?C,?C++
Siam Quantum Free,?GPL C
SIESTA Free,?GPL Fortran
TB-LMTO Academic Fortran
TeraChem?8 Commercial C,?CUDA
TURBOMOLE Commercial Fortran
VASP Academic (AT), commercial Fortran
WIEN2k Commercial Fortran,C
Yambo Code Some parts GPL Fortran
總計 FORTRAN ( 77,90, 95,2003) 55
Python 7
C,C++ 34
FORTRAN 在量子化學和固態物理方面的軟體市占率大獲全勝
說屌打也行
真是讓人意外!!
以後學生會改學FORTRAN嗎??
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※ 文章網址: https://www.ptt.cc/bbs/Gossiping/M.1479803926.A.2FF.html
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推
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我那年代一堆人鄙視Fortran耶
你所謂一推人在學是啥麼時候的事情?
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沒你想的那麼簡單吧? Fortran 也是進化不少
現在語法支援度和架構根本不輸C了
但速度還比C略快
※ 編輯: peter308 (140.115.30.19), 11/22/2016 16:42:28
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我FORTRAN是超熟的拉XD 賺到!!
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※ 編輯: peter308 (140.115.30.19), 11/22/2016 16:45:18
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你不能從你自己觀點看這件事情
可能有的新手對科學比較有興趣的看了我這篇文章後跑去改學Fortran啊
※ 編輯: peter308 (140.115.30.19), 11/22/2016 16:50:43
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※ 編輯: peter308 (140.115.30.19), 11/22/2016 16:54:28
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當然不是啊 在工作惹
※ 編輯: peter308 (140.115.30.19), 11/22/2016 16:59:26
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