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Gaussian 03 Rev.E01 | Benchmark of GAUSSIAN 03 rev E01 compiled by Intel Fortran Compiler 10.1 in EM64T platforms only. | All tests passed except two tests ..... (Read more) |
Linux: fce 10.1.011 and cce 10.1.011, with MKL 10.0.1.014. | |||
Gaussian 03 Rev.E01 | Benchmark of GAUSSIAN 03 rev E01 compiled by Intel Fortran Compiler 9.1 in EM64T platforms only. | All tests passed except two tests ..... (Read more) |
Linux: fce 9.1.052 and cce 9.1.052, with MKL 10.0.1.014. | |||
Gaussian 03 Rev.D01 | Benchmark of GAUSSIAN 03 rev D01 compiled by Intel Fortran Compiler 9.0. | All tests passed except 3 tests ..... (Read more) |
EM64T: fce 9.0.033 and cce 9.0.032, with MKL 8.1.014. IA32: v8.1 is suggested. | |||
Gaussian 03 Rev.C02 | Benchmark of GAUSSIAN 03 rev C02 compiled by Intel Fortran Compiler 9.0. | Finished. |
For EM64T,1,2 use fce 9.0.021+. Working numerical libraries: MKL 7.2cluster, ACML. |
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Gaussian 03 Rev.C02 | Benchmark of GAUSSIAN 03 rev C02 compiled by Intel Fortran Compiler 7.0 and 7.1. |
Finished. |
To get rid of annoying runtime complaints about initialization of libguide.so, use IFC 7.1 Build 20040309Z and after. | |||
Gaussian 98 Rev.A11.3 | Benchmark of GAUSSIAN 98 in Linux system including Intel P4/Xeon, Itanium-2, and AMD Opteron in 32-bit, as well as IBM P690 (AIX) | J. Chem. Inf. Comput. Sci. 44, 635-642 (2004) | ||||
Gaussian 98 Rev.A11 | Benchmark of GAUSSIAN 98 in PC-Linux systems with various hardware configurations (Intel P4 Willamette, AMD Athlon TB/XP/MP, Alpha 21264A and SGI R12000), compilers (PGI Fortran v3.2 and Intel Fortran v5.0) as well as numerical libraries (BLAS/ATLAS) | J. Chem. Inf. Comput. Sci. 42, 673-681 (2002) | ||||
Gaussian 94 | Benchmark of the PC-UNIX Computer with Electronic Structure Calculation | J. Chem. Inf. Comput. Sci. 37, 1111 -1114 (1997) |