| .. |
|
ammonia_CC3_aug-cc-pVDZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CC3_aug-cc-pVQZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CC3_aug-cc-pVTZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDT_aug-cc-pVDZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDT_aug-cc-pVQZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDT_aug-cc-pVTZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDTQ_aug-cc-pVDZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDTQ_aug-cc-pVTZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_CCSDTQP_aug-cc-pVDZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_exFCI_aug-cc-pVDZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_exFCI_aug-cc-pVQZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_exFCI_aug-cc-pVTZ.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
ammonia_exp.dat
|
Add ammonia abs data
|
2019-10-07 17:51:12 +02:00 |
|
hydrogen_chloride_CC3_aug-cc-pVDZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CC3_aug-cc-pVQZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CC3_aug-cc-pVTZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDT_aug-cc-pVDZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDT_aug-cc-pVQZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDT_aug-cc-pVTZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDTQ_aug-cc-pVDZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDTQ_aug-cc-pVTZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_CCSDTQP_aug-cc-pVDZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_exFCI_aug-cc-pVDZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_exFCI_aug-cc-pVQZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_chloride_exFCI_aug-cc-pVTZ.dat
|
Add data for hydrogen chloride absorption
|
2019-10-07 18:23:02 +02:00 |
|
hydrogen_sulfide_CC3_aug-cc-pVDZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CC3_aug-cc-pVQZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CC3_aug-cc-pVTZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDT_aug-cc-pVDZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDT_aug-cc-pVQZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDT_aug-cc-pVTZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDTQ_aug-cc-pVDZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDTQ_aug-cc-pVTZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_CCSDTQP_aug-cc-pVDZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_exFCI_aug-cc-pVDZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_exFCI_aug-cc-pVQZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_exFCI_aug-cc-pVTZ.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
hydrogen_sulfide_exp.dat
|
Add hydrogen sulfide absorption files
|
2019-09-30 18:26:32 +02:00 |
|
water_CC3_aug-cc-pVDZ.dat
|
Rename and and fix comment
|
2019-09-27 15:33:55 +02:00 |
|
water_CC3_aug-cc-pVQZ.dat
|
Add aug-cc-pVQZ for water
|
2019-09-30 18:13:12 +02:00 |
|
water_CC3_aug-cc-pVTZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_CCSDT_aug-cc-pVDZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_CCSDT_aug-cc-pVQZ.dat
|
Add aug-cc-pVQZ for water
|
2019-09-30 18:13:12 +02:00 |
|
water_CCSDT_aug-cc-pVTZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_CCSDTQ_aug-cc-pVDZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_CCSDTQ_aug-cc-pVTZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_CCSDTQP_aug-cc-pVDZ.dat
|
Fix CCSDTQP
|
2019-09-28 13:53:33 +02:00 |
|
water_exFCI_aug-cc-pVDZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_exFCI_aug-cc-pVQZ.dat
|
Add aug-cc-pVQZ for water
|
2019-09-30 18:13:12 +02:00 |
|
water_exFCI_aug-cc-pVTZ.dat
|
Adapt files to the new format
|
2019-09-27 15:33:55 +02:00 |
|
water_exp.dat
|
Fix spaces and Cie on Water exp
|
2019-09-27 20:18:32 +02:00 |
