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Renamed test inputs

This commit is contained in:
Anthony Scemama 2014-04-07 15:12:03 +02:00
parent de6af26a8b
commit 346731bddc
425 changed files with 4250 additions and 4228 deletions
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data/inputs/Al+.md5 Normal file
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808031ee533705b5cac58056ebd3b5c4 Al+.ezfio/ao_basis/ao_coef.gz
61eead7d1de1b73337744006ba5e6822 Al+.ezfio/ao_basis/ao_expo.gz
5353d95a83852faf20b455ad57b8311d Al+.ezfio/ao_basis/ao_nucl.gz
a62103800a061f58b2b696f7c5119e54 Al+.ezfio/ao_basis/ao_num
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ea33607dca68f44c74b4060a7eeff95f Al+.ezfio/ao_basis/ao_prim_num.gz
503018260a2f6fc8557fcf29300fa8bb Al+.ezfio/electrons/elec_alpha_num
503018260a2f6fc8557fcf29300fa8bb Al+.ezfio/electrons/elec_beta_num
3f708499876f92eaf350d3ac7d89d18c Al+.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf Al+.ezfio/ezfio/library
51a89607357b1309bda52b2943f25bae Al+.ezfio/mo_basis/mo_coef.gz
23f6643104f2206a9e692fecc16d1fdf Al+.ezfio/mo_basis/mo_energy.gz
4b752f0c6bd89811f15963699a6323a0 Al+.ezfio/mo_basis/mo_label
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0b99523d4e44508cf890355dae0d09c8 Al+.ezfio/mo_basis/mo_symmetry.gz
dcb3ca24a097368c672b71dcd834777b Al+.ezfio/mo_basis/mo_tot_num
0ce1b7570cd7f051ba332295d37740f8 Al+.ezfio/nuclei/nucl_charge.gz
3316d1f857fcbd7039fdf2f4f6c1f968 Al+.ezfio/nuclei/nucl_coord.gz
765e1f05dd3fbab8c7ebefaf2f1813e4 Al+.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b Al+.ezfio/output/empty

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data/inputs/Al+.out.ezfio.md5
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808031ee533705b5cac58056ebd3b5c4 Al+.out.ezfio/ao_basis/ao_coef.gz
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503018260a2f6fc8557fcf29300fa8bb Al+.out.ezfio/electrons/elec_alpha_num
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9104e54c37d062209b247e0132dbb74b Al+.out.ezfio/output/empty

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a62103800a061f58b2b696f7c5119e54 Al.ezfio/ao_basis/ao_num
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503018260a2f6fc8557fcf29300fa8bb Al.ezfio/electrons/elec_beta_num
3f708499876f92eaf350d3ac7d89d18c Al.ezfio/ezfio/creation
7f367b65714301b397509954da600ecf Al.ezfio/ezfio/library
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4b752f0c6bd89811f15963699a6323a0 Al.ezfio/mo_basis/mo_label
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765e1f05dd3fbab8c7ebefaf2f1813e4 Al.ezfio/nuclei/nucl_num
9104e54c37d062209b247e0132dbb74b Al.ezfio/output/empty

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data/inputs/Al.out.ezfio.md5
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49b9859a17c832f9c3c88e5de7aa8a8f Al.out.ezfio/ao_basis/ao_coef.gz
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9104e54c37d062209b247e0132dbb74b Al.out.ezfio/output/empty

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data/inputs/AlCl.md5 Normal file
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85c1c07e11160f2ef30940cb44a39447 AlCl.ezfio/ao_basis/ao_expo.gz
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data/inputs/AlCl.out.ezfio.md5
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data/inputs/AlH.out.ezfio.md5
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data/inputs/AlH2.out.ezfio.md5
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data/inputs/AlH3.md5 Normal file
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