User contributions for Ftran
8 February 2024
- 15:0115:01, 8 February 2024 diff hist +22 LIBMBD C6AU No edit summary
- 15:0015:00, 8 February 2024 diff hist +22 LIBMBD ALPHA No edit summary
- 14:5314:53, 8 February 2024 diff hist +1,832 N LIBMBD C6AU Created page with "{{DISPLAYTITLE:LIBMBD_C6AU}} {{TAGDEF|LIBMBD_C6AU|[real array]}} Description: {{TAG|LIBMBD_C6AU}} defines the free-atom <math>C_6</math> parameters (<math>\mathrm{Hartree}</math> <math>\mathrm{bohr}^{6}</math>) within the Tkatchenko-Scheffler and many-body methods as implemented in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_C6AU}} allows to set values fo..."
- 14:5214:52, 8 February 2024 diff hist +4 LIBMBD ALPHA No edit summary
- 14:4714:47, 8 February 2024 diff hist −6 LIBMBD ALPHA No edit summary
- 14:4614:46, 8 February 2024 diff hist +136 LIBMBD ALPHA No edit summary
- 14:4414:44, 8 February 2024 diff hist +1 LIBMBD ALPHA No edit summary
- 14:4314:43, 8 February 2024 diff hist −2 LIBMBD ALPHA No edit summary
- 14:4214:42, 8 February 2024 diff hist −7 LIBMBD ALPHA No edit summary
- 14:3914:39, 8 February 2024 diff hist +44 LIBMBD ALPHA No edit summary
- 13:3013:30, 8 February 2024 diff hist −1 LIBMBD ALPHA No edit summary
- 13:2213:22, 8 February 2024 diff hist +1 LIBMBD ALPHA No edit summary
- 12:5612:56, 8 February 2024 diff hist −6 LIBMBD ALPHA No edit summary
- 12:5512:55, 8 February 2024 diff hist +143 LIBMBD ALPHA No edit summary
- 12:5112:51, 8 February 2024 diff hist +1,476 N LIBMBD ALPHA Created page with "{{DISPLAYTITLE:LIBMBD_ALPHA}} {{TAGDEF|LIBMBD_ALPHA|real (array)}} Description: {{TAG|LIBMBD_ALPHA}} sets the value of the damping parameter <math>a</math> in the many-body methods as implemented in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_ALPHA}} allows to choose the value of the damping parameter <math>a</math> in the many-body methods as implemented in the library libMBD of many-b..."
- 12:3612:36, 8 February 2024 diff hist +5 LIBMBD VDW PARAMS KIND No edit summary
- 12:3512:35, 8 February 2024 diff hist −14 LIBMBD VDW PARAMS KIND No edit summary
- 11:3111:31, 8 February 2024 diff hist +8 LIBMBD VDW PARAMS KIND No edit summary
- 11:2511:25, 8 February 2024 diff hist −126 LTSSURF No edit summary current
- 11:2411:24, 8 February 2024 diff hist +26 LIBMBD VDW PARAMS KIND No edit summary
- 11:2311:23, 8 February 2024 diff hist +37 LIBMBD VDW PARAMS KIND No edit summary
- 11:2211:22, 8 February 2024 diff hist +335 Template:Cite No edit summary
- 11:2011:20, 8 February 2024 diff hist −3 Template:Cite No edit summary
- 11:1111:11, 8 February 2024 diff hist +61 LIBMBD VDW PARAMS KIND No edit summary
- 11:0811:08, 8 February 2024 diff hist −135 LIBMBD VDW PARAMS KIND No edit summary
- 11:0011:00, 8 February 2024 diff hist +54 LIBMBD VDW PARAMS KIND No edit summary
- 10:5810:58, 8 February 2024 diff hist −2 LIBMBD VDW PARAMS KIND No edit summary
- 10:5810:58, 8 February 2024 diff hist −9 LIBMBD VDW PARAMS KIND No edit summary
- 10:5810:58, 8 February 2024 diff hist −73 LIBMBD VDW PARAMS KIND No edit summary
- 10:5610:56, 8 February 2024 diff hist +30 LIBMBD VDW PARAMS KIND No edit summary
- 10:5410:54, 8 February 2024 diff hist +1,808 N LIBMBD VDW PARAMS KIND Created page with "{{DISPLAYTITLE:LIBMBD_TS_SR}} {{TAGDEF|LIBMBD_TS_SR|[real]|value that was determined for the exchange-correlation functional set with {{TAG|LIBMBD_XC}}}} Description: {{TAG|LIBMBD_TS_SR}} sets the value of the scaling factor <math>s_R</math> in the Tkatchenko-Scheffler method{{cite|tkatchenko:prl:09}} as implemented in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_TS_SR}} allows to choose..."
7 February 2024
- 16:5216:52, 7 February 2024 diff hist +23 LIBMBD K GRID SHIFT No edit summary
- 16:5116:51, 7 February 2024 diff hist +29 LIBMBD K GRID No edit summary
- 16:5016:50, 7 February 2024 diff hist +19 LIBMBD TS D No edit summary
- 16:5016:50, 7 February 2024 diff hist −3 LIBMBD MBD A No edit summary
- 16:5016:50, 7 February 2024 diff hist 0 LIBMBD MBD A No edit summary
- 16:4816:48, 7 February 2024 diff hist +22 LIBMBD MBD A No edit summary
- 16:4616:46, 7 February 2024 diff hist +19 LIBMBD MBD BETA No edit summary
- 16:4216:42, 7 February 2024 diff hist +7 LIBMBD MBD BETA No edit summary
- 16:4116:41, 7 February 2024 diff hist +35 LIBMBD MBD BETA No edit summary
- 16:3916:39, 7 February 2024 diff hist +1,733 N LIBMBD MBD BETA Created page with "{{DISPLAYTITLE:LIBMBD_MBD_BETA}} {{TAGDEF|LIBMBD_MBD_BETA|[real]|value that was determined for the exchange-correlation functional set with {{TAG|LIBMBD_XC}}}} Description: {{TAG|LIBMBD_MBD_BETA}} sets the value of the scaling factor <math>\beta</math> in the many-body methods as implemented in the library libMBD of many-body dispersion methods{{cite|libmbd_1}}{{cite|libmbd_2}}{{cite|hermann:jcp:2023}}. ---- {{TAG|LIBMBD_MBD_BETA}} allows to choose the value of the damp..."
- 16:3916:39, 7 February 2024 diff hist +1 LIBMBD TS D No edit summary
- 16:3316:33, 7 February 2024 diff hist −14 LIBMBD MBD A No edit summary
- 16:3116:31, 7 February 2024 diff hist +80 LIBMBD TS D No edit summary
- 16:3016:30, 7 February 2024 diff hist +25 LIBMBD MBD A No edit summary
- 16:2916:29, 7 February 2024 diff hist 0 LIBMBD MBD A No edit summary
- 16:2816:28, 7 February 2024 diff hist +81 LIBMBD MBD A No edit summary
- 16:2716:27, 7 February 2024 diff hist −312 LIBMBD MBD A No edit summary
- 16:2416:24, 7 February 2024 diff hist +61 VDW SR No edit summary
- 16:2316:23, 7 February 2024 diff hist +61 VDW SR No edit summary