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data_Be_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_Be_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_Be_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_BeH_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_BeH_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_BeH_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C2H2_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_C2H2_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_C2H2_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C2H4_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C2H4_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_C2H4_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C2H6_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_C2H6_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_C2H6_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CH_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH2_1A1_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CH2_1A1_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CH2_1A1_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CH2_3B1_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH2_3B1_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CH2_3B1_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3Cl_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3Cl_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH3Cl_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH4_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH4_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CH4_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_Cl_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_Cl_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_Cl_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_Cl2_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_Cl2_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_Cl2_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_ClF_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_ClF_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_ClF_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_ClO_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_ClO_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_ClO_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_CN_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CN_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CN_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO2_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO2_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CO2_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CS_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CS_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_CS_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_F_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_F_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_F_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_F2_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_F2_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_F2_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_final_VDZ
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added final data
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2018-12-19 14:26:23 +01:00 |
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data_H_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H2CO_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H2CO_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2CO_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_H2O_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2O_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2O_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2O2_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H2O2_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_H2O2_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_H2S_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2S_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H2S_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_H3COH_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H3COH_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H3COH_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_H3CSH_cc-pVDZ
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adde data_sr_dft_new/
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2018-12-19 12:47:52 +01:00 |
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data_H3CSH_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_H3CSH_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HCl_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_HCl_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_HCl_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HCN_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_HCN_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HCN_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HCO_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_HCO_cc-pVDZ_HF_LDA
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
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data_HCO_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HF_cc-pVDZ
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HF_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HF_cc-pVDZ_HF_PBE
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adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HOCl_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HOCl_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_HOCl_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Li2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiF_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiF_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiF_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiH_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiH_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_LiH_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2H4_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2H4_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_N2H4_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Na2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NaCl_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NaCl_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NaCl_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH3_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH3_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NH3_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NO_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NO_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_NO_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_O2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_OH_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_OH_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_OH_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_P2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH3_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH3_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_PH3_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_S2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2H6_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2H6_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_Si2H6_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_1A1_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_1A1_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_1A1_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_3B1_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_3B1_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH2_3B1_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH3_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH3_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH3_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH4_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH4_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiH4_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiO_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiO_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SiO_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO2_cc-pVDZ
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO2_cc-pVDZ_HF_LDA
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
|
data_SO2_cc-pVDZ_HF_PBE
|
adde data_sr_dft_new/
|
2018-12-19 12:47:52 +01:00 |
