ASE database

Displaying rows 1-8 out of 8

↓ ID ✕	Formula ✕	Age ✕	no_equ_4 ✕	PBC ✕	no_equ_27 ✕	ads_E ✕
1	Cu₅₄Li	13M	ratio:1,dipole:-2.353,distance:1.877,ads_E:-2.141	TTT	-	-2.222
2	BeCu₅₄	13M	ratio:1,dipole:0.00345513,distance:0.973808,ads_E:-2.95616	TTT	-	-2.934
3	Cu₅₄B	13M	ratio:1.000,dipole:0.557,distance:0.353,ads_E:-5.662	TTT	-	-5.472
4	Cu₅₄C	13M	ratio:1,dipole:0.52283,distance:0.266163,ads_E:-6.42427	TTT	-	-6.254
5	Cu₅₄N	13M	ratio:1,dipole:0.368,distance:0.386,ads_E:-4.725	TTT	-	-4.599
6	Cu₅₄O	13M	ratio:1.000,dipole:0.486,distance:0.778,ads_E:-5.406	TTT	-	-5.385
7	Cu₅₄F	13M	ratio:1.000,dipole:0.693,distance:1.239,ads_E:-4.335	TTT	-	-4.264
8	Cu₅₄Ar	13M	ratio:0.96,dipole:-0.291,distance:3.002,ads_E:0.057	TTT	ratio:1.42,dipole:0.000,distance:9.243,ads_E:-0.005	0.020