cyrusyc commited on
Commit
3129b3c
·
1 Parent(s): a775f53

save RM24 in json

Browse files
.gitattributes CHANGED
@@ -55,80 +55,11 @@ saved_model/**/* filter=lfs diff=lfs merge=lfs -text
55
  *.webp filter=lfs diff=lfs merge=lfs -text
56
  stability/random-mixture.db filter=lfs diff=lfs merge=lfs -text
57
  combustion/mace-mp/MACE-MP(M)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
58
- combustion/mace-mp/H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
59
- combustion/sevennet/H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
60
  combustion/sevennet/SevenNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
61
  combustion/orb/ORBv2_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
62
  combustion/orb/ORB_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
63
  combustion/equiformer/EquiformerV2(OC20)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
64
  combustion/chgnet/CHGNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
65
- combustion/chgnet/H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
66
  combustion/escn/eSCN(OC20)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
67
- combustion/escn/run-H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
68
- combustion/escn/H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
69
  combustion/matgl/M3GNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
70
- mace-mp/MACE-MP(M)_random_Ca36Ga54Sn18Tm30Zn18_npt.traj filter=lfs diff=lfs merge=lfs -text
71
- mace-mp/MACE-MP(M)_random_Eu16Fe4Ga32Ir12Te64_npt.traj filter=lfs diff=lfs merge=lfs -text
72
- mace-mp/MACE-MP(M)_random_C20Co400Gd80Th10_npt.traj filter=lfs diff=lfs merge=lfs -text
73
- mace-mp/MACE-MP(M)_random_Rh4Se31Sn44Te220Tl88U12_npt.traj filter=lfs diff=lfs merge=lfs -text
74
- mace-mp/MACE-MP(M)_random_Al448F156Fe78Ni112Y112_npt.traj filter=lfs diff=lfs merge=lfs -text
75
- mace-mp/MACE-MP(M)_random_Al176Gd116Mg58Ni204Tb88_npt.traj filter=lfs diff=lfs merge=lfs -text
76
- mace-mp/MACE-MP(M)_random_Cs18Er48I54Nb12Pt64_npt.traj filter=lfs diff=lfs merge=lfs -text
77
- mace-mp/MACE-MP(M)_random_C352Er176Fe14W148_npt.traj filter=lfs diff=lfs merge=lfs -text
78
- mace-mp/MACE-MP(M)_random_B296Se266Ti220Tl76_npt.traj filter=lfs diff=lfs merge=lfs -text
79
- mace-mp/MACE-MP(M)_random_Bi80Li48Ni80S10Sb32Y16_npt.traj filter=lfs diff=lfs merge=lfs -text
80
- mace-mp/MACE-MP(M)_random_As788Cs184Mo180Na92_npt.traj filter=lfs diff=lfs merge=lfs -text
81
- mace-mp/MACE-MP(M)_random_Mn72Na432O42P6Se288Sm18_npt.traj filter=lfs diff=lfs merge=lfs -text
82
- mace-mp/MACE-MP(M)_random_Bi24Co18Er72Ge30Mn12Tb12_npt.traj filter=lfs diff=lfs merge=lfs -text
83
- sevennet/SevenNet_random_Al448F156Fe78Ni112Y112_npt.traj filter=lfs diff=lfs merge=lfs -text
84
- sevennet/SevenNet_random_Ca36Ga54Sn18Tm30Zn18_npt.traj filter=lfs diff=lfs merge=lfs -text
85
- sevennet/SevenNet_random_As788Cs184Mo180Na92_npt.traj filter=lfs diff=lfs merge=lfs -text
86
- sevennet/SevenNet_random_B296Se266Ti220Tl76_npt.traj filter=lfs diff=lfs merge=lfs -text
87
- sevennet/SevenNet_random_Al176Gd116Mg58Ni204Tb88_npt.traj filter=lfs diff=lfs merge=lfs -text
88
- sevennet/SevenNet_random_Rh4Se31Sn44Te220Tl88U12_npt.traj filter=lfs diff=lfs merge=lfs -text
89
- sevennet/SevenNet_random_C20Co400Gd80Th10_npt.traj filter=lfs diff=lfs merge=lfs -text
90
- sevennet/SevenNet_random_Cs18Er48I54Nb12Pt64_npt.traj filter=lfs diff=lfs merge=lfs -text
91
- sevennet/SevenNet_random_Eu16Fe4Ga32Ir12Te64_npt.traj filter=lfs diff=lfs merge=lfs -text
92
- sevennet/SevenNet_random_C352Er176Fe14W148_npt.traj filter=lfs diff=lfs merge=lfs -text
93
- sevennet/SevenNet_random_Bi80Li48Ni80S10Sb32Y16_npt.traj filter=lfs diff=lfs merge=lfs -text
94
- sevennet/SevenNet_random_Bi24Co18Er72Ge30Mn12Tb12_npt.traj filter=lfs diff=lfs merge=lfs -text
95
- sevennet/SevenNet_random_Mn72Na432O42P6Se288Sm18_npt.traj filter=lfs diff=lfs merge=lfs -text
96
- orb/ORBv2_random_Eu16Fe4Ga32Ir12Te64_npt.traj filter=lfs diff=lfs merge=lfs -text
97
- orb/ORBv2_random_Bi24Co18Er72Ge30Mn12Tb12_npt.traj filter=lfs diff=lfs merge=lfs -text
98
- orb/ORBv2_random_Bi80Li48Ni80S10Sb32Y16_npt.traj filter=lfs diff=lfs merge=lfs -text
99
- orb/ORBv2_random_Al448F156Fe78Ni112Y112_npt.traj filter=lfs diff=lfs merge=lfs -text
100
- orb/ORBv2_random_Cs18Er48I54Nb12Pt64_npt.traj filter=lfs diff=lfs merge=lfs -text
101
- orb/ORBv2_random_As788Cs184Mo180Na92_npt.traj filter=lfs diff=lfs merge=lfs -text
102
- orb/ORBv2_random_C352Er176Fe14W148_npt.traj filter=lfs diff=lfs merge=lfs -text
103
- orb/ORBv2_random_Rh4Se31Sn44Te220Tl88U12_npt.traj filter=lfs diff=lfs merge=lfs -text
104
- orb/ORBv2_random_C20Co400Gd80Th10_npt.traj filter=lfs diff=lfs merge=lfs -text
105
- orb/ORBv2_random_Al176Gd116Mg58Ni204Tb88_npt.traj filter=lfs diff=lfs merge=lfs -text
106
- orb/ORBv2_random_B296Se266Ti220Tl76_npt.traj filter=lfs diff=lfs merge=lfs -text
107
- orb/ORBv2_random_Ca36Ga54Sn18Tm30Zn18_npt.traj filter=lfs diff=lfs merge=lfs -text
108
- mattersim/MatterSim_random_Al176Gd116Mg58Ni204Tb88_npt.traj filter=lfs diff=lfs merge=lfs -text
109
- mattersim/MatterSim_random_Ca36Ga54Sn18Tm30Zn18_npt.traj filter=lfs diff=lfs merge=lfs -text
110
- mattersim/MatterSim_random_Eu16Fe4Ga32Ir12Te64_npt.traj filter=lfs diff=lfs merge=lfs -text
111
- mattersim/MatterSim_random_Mn72Na432O42P6Se288Sm18_npt.traj filter=lfs diff=lfs merge=lfs -text
112
- mattersim/MatterSim_random_Bi24Co18Er72Ge30Mn12Tb12_npt.traj filter=lfs diff=lfs merge=lfs -text
113
- mattersim/MatterSim_random_Bi80Li48Ni80S10Sb32Y16_npt.traj filter=lfs diff=lfs merge=lfs -text
114
- mattersim/MatterSim_random_Al448F156Fe78Ni112Y112_npt.traj filter=lfs diff=lfs merge=lfs -text
115
- mattersim/MatterSim_random_Cs18Er48I54Nb12Pt64_npt.traj filter=lfs diff=lfs merge=lfs -text
116
- mattersim/MatterSim_random_B296Se266Ti220Tl76_npt.traj filter=lfs diff=lfs merge=lfs -text
117
- mattersim/MatterSim_random_C20Co400Gd80Th10_npt.traj filter=lfs diff=lfs merge=lfs -text
118
- mattersim/MatterSim_random_As788Cs184Mo180Na92_npt.traj filter=lfs diff=lfs merge=lfs -text
119
- mattersim/MatterSim_random_C352Er176Fe14W148_npt.traj filter=lfs diff=lfs merge=lfs -text
120
- mattersim/MatterSim_random_Rh4Se31Sn44Te220Tl88U12_npt.traj filter=lfs diff=lfs merge=lfs -text
121
- chgnet/CHGNet_random_Ca36Ga54Sn18Tm30Zn18_npt.traj filter=lfs diff=lfs merge=lfs -text
122
- chgnet/CHGNet_random_Cs18Er48I54Nb12Pt64_npt.traj filter=lfs diff=lfs merge=lfs -text
123
- chgnet/CHGNet_random_C352Er176Fe14W148_npt.traj filter=lfs diff=lfs merge=lfs -text
124
- chgnet/CHGNet_random_Bi24Co18Er72Ge30Mn12Tb12_npt.traj filter=lfs diff=lfs merge=lfs -text
125
- chgnet/CHGNet_random_Al176Gd116Mg58Ni204Tb88_npt.traj filter=lfs diff=lfs merge=lfs -text
126
- chgnet/CHGNet_random_Bi80Li48Ni80S10Sb32Y16_npt.traj filter=lfs diff=lfs merge=lfs -text
127
- chgnet/CHGNet_random_B296Se266Ti220Tl76_npt.traj filter=lfs diff=lfs merge=lfs -text
128
- chgnet/CHGNet_random_Eu16Fe4Ga32Ir12Te64_npt.traj filter=lfs diff=lfs merge=lfs -text
129
- chgnet/CHGNet_random_Mn72Na432O42P6Se288Sm18_npt.traj filter=lfs diff=lfs merge=lfs -text
130
- chgnet/CHGNet_random_C20Co400Gd80Th10_npt.traj filter=lfs diff=lfs merge=lfs -text
131
- chgnet/CHGNet_random_As788Cs184Mo180Na92_npt.traj filter=lfs diff=lfs merge=lfs -text
132
- chgnet/CHGNet_random_Rh4Se31Sn44Te220Tl88U12_npt.traj filter=lfs diff=lfs merge=lfs -text
133
- chgnet/CHGNet_random_Al448F156Fe78Ni112Y112_npt.traj filter=lfs diff=lfs merge=lfs -text
134
- pscratch/sd/c/cyrusyc/mlip-arena/examples/stability filter=lfs diff=lfs merge=lfs -text
 
55
  *.webp filter=lfs diff=lfs merge=lfs -text
56
  stability/random-mixture.db filter=lfs diff=lfs merge=lfs -text
57
  combustion/mace-mp/MACE-MP(M)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
 
 
58
  combustion/sevennet/SevenNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
59
  combustion/orb/ORBv2_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
60
  combustion/orb/ORB_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
61
  combustion/equiformer/EquiformerV2(OC20)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
62
  combustion/chgnet/CHGNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
 
63
  combustion/escn/eSCN(OC20)_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
 
 
64
  combustion/matgl/M3GNet_H256O128.extxyz filter=lfs diff=lfs merge=lfs -text
65
+ stability/RM24.db filter=lfs diff=lfs merge=lfs -text
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
.gitignore ADDED
@@ -0,0 +1 @@
 
 
1
+ **/.*/
combustion/alignn/H256O128.extxyz DELETED
The diff for this file is too large to render. See raw diff
 
combustion/escn/run-H256O128.extxyz DELETED
@@ -1,3 +0,0 @@
1
- version https://git-lfs.github.com/spec/v1
2
- oid sha256:ecbdc0a3d8122a9c1f30c34e78765c618c6c84dd98a60a6a93f72e57e73472ea
3
- size 18634287
 
 
 
 
combustion/mace-mp/H256O128.extxyz DELETED
@@ -1,3 +0,0 @@
1
- version https://git-lfs.github.com/spec/v1
2
- oid sha256:25328264508f9236ce08ced0ffc3dac4ba1e613c60f5c26536f001af27c79721
3
- size 120728697
 
 
 
 
combustion/matgl/H256O128.extxyz DELETED
The diff for this file is too large to render. See raw diff
 
combustion/sevennet/H256O128.extxyz DELETED
@@ -1,3 +0,0 @@
1
- version https://git-lfs.github.com/spec/v1
2
- oid sha256:6ba3cefcabf58d102decef0f6c3cc0a110604a9aec6c943ad0a78be423d365e4
3
- size 105174008
 
 
 
 
combustion/test/H256O128.extxyz DELETED
@@ -1,386 +0,0 @@
1
- 384
2
- Lattice="30.0 0.0 0.0 0.0 30.0 0.0 0.0 0.0 30.0" Properties=species:S:1:pos:R:3 Built=T with=T Packmol=T pbc="T T T"
3
- H 6.71669500 27.40330700 13.68784000
4
- H 6.56413900 26.94187400 13.13356600
5
- H 4.01874500 24.54731500 2.42614400
6
- H 4.06326800 24.60306800 1.69243900
7
- H 19.81990800 11.97306900 11.66638000
8
- H 19.80020800 12.70644500 11.59436300
9
- H 28.98607000 12.86336400 12.19767400
10
- H 29.00971400 12.88360500 12.93418200
11
- H 10.37632500 7.60336700 9.09607600
12
- H 10.09412100 7.01607100 9.44083300
13
- H 10.21969400 27.00047900 10.37176700
14
- H 9.56226800 26.66727600 10.35833100
15
- H 3.51642300 4.64618300 13.26100400
16
- H 3.19087000 4.01330300 13.06893100
17
- H 17.07272200 26.43633800 3.97721600
18
- H 17.76156200 26.60077000 4.18185100
19
- H 3.58254200 8.40601100 1.85885100
20
- H 3.32028600 8.99119200 1.49526000
21
- H 20.93526200 14.99894700 19.94272400
22
- H 20.92651600 14.99223100 20.67980700
23
- H 26.78606500 14.69290300 18.64689300
24
- H 26.43088200 14.16219600 19.01514500
25
- H 23.31077000 25.02192200 25.42458800
26
- H 23.23137700 24.98837100 26.15669800
27
- H 4.23870900 22.06352800 2.24193700
28
- H 4.13605700 21.89474500 2.95214000
29
- H 17.19183000 13.50635300 20.97020900
30
- H 17.33285700 13.55720300 20.24844800
31
- H 11.40128700 21.01758100 13.20015300
32
- H 11.23939200 21.24064200 13.88385500
33
- H 8.08553400 17.35614800 4.83985100
34
- H 7.85698800 18.00868300 4.58416100
35
- H 18.23851700 17.87971000 18.64072400
36
- H 18.18586700 17.93400600 19.37400000
37
- H 7.67448900 9.27045600 9.58857400
38
- H 8.38197500 9.28217700 9.38183700
39
- H 22.81810900 7.01891100 11.62916000
40
- H 23.02343500 6.88860700 10.93326000
41
- H 7.00678500 28.41965000 16.15063200
42
- H 6.61194800 29.00429800 16.36441700
43
- H 10.22790300 12.62515700 19.02217900
44
- H 10.06283300 12.03600000 19.43334700
45
- H 5.67633000 19.26890500 3.09689400
46
- H 6.16859600 19.35120500 3.63940200
47
- H 7.83689900 28.57325000 6.00799800
48
- H 8.20904000 29.01838100 5.55326500
49
- H 24.24356500 1.95484800 23.83583200
50
- H 24.33048700 1.23652000 23.97677000
51
- H 8.15609200 12.56884200 2.83826200
52
- H 8.47473700 12.51613700 2.17561500
53
- H 1.98944400 22.63517100 9.38706600
54
- H 1.99816600 22.52032700 8.65895300
55
- H 3.21198500 13.34481400 26.27085600
56
- H 2.83315800 12.78596400 26.56681200
57
- H 23.13687400 14.90616700 17.31808300
58
- H 23.60063200 15.47147100 17.41174900
59
- H 24.37760200 23.67694500 6.16965600
60
- H 24.26969800 23.54491000 5.45248300
61
- H 12.12534300 0.92505100 5.56915800
62
- H 12.59580200 1.08149500 6.11469100
63
- H 14.77057800 23.04450600 14.78597800
64
- H 14.88153400 22.32226700 14.88331100
65
- H 10.12077400 6.02995200 19.27346700
66
- H 10.56701000 5.58085700 19.65109300
67
- H 8.88571400 26.92992500 13.97009200
68
- H 9.13262800 27.42418800 13.48208400
69
- H 13.61412900 25.32932600 5.89573200
70
- H 14.17465000 25.02676400 5.52467300
71
- H 17.25064000 9.39374700 16.24924400
72
- H 17.23228900 9.42911200 16.98533300
73
- H 12.66108800 13.49816800 7.35969900
74
- H 12.75204000 13.66251500 6.64686500
75
- H 19.85540500 12.40447200 18.67913500
76
- H 19.87736300 13.08567100 18.39824500
77
- H 21.16039700 14.54404800 12.22178400
78
- H 20.77918300 14.69154600 11.60832300
79
- H 1.89709500 13.01516500 11.87415000
80
- H 1.61578300 12.78775700 11.23183900
81
- H 22.48727800 20.55335700 26.81374300
82
- H 22.08316200 19.93770500 26.84656000
83
- H 18.09641200 11.03175000 20.02888200
84
- H 18.08987100 11.14550300 19.30057500
85
- H 9.03487100 28.27705600 17.67592300
86
- H 9.02850300 28.47186100 18.38685500
87
- H 21.61332100 18.16863300 14.82530000
88
- H 20.91922800 18.33149900 15.01271300
89
- H 5.06777300 6.91012100 12.14248900
90
- H 5.14167800 7.53010400 12.53437400
91
- H 15.24240300 1.00156500 8.79894400
92
- H 15.15041500 1.70061000 8.58379800
93
- H 7.38156900 16.75420300 20.84490000
94
- H 7.49809200 17.42858000 20.57094300
95
- H 5.80395600 5.23791900 23.23164500
96
- H 5.59378400 5.32074900 23.93334300
97
- H 25.86193300 21.36196900 25.55815300
98
- H 26.43947000 21.14184700 25.15639300
99
- H 15.99876300 19.78997000 1.87456100
100
- H 15.41808700 19.79298200 2.32867600
101
- H 13.76283200 27.95478100 8.97671100
102
- H 13.72689900 27.99668400 8.24161500
103
- H 3.90503500 26.10922400 10.77631300
104
- H 3.36520200 25.83210000 11.19487700
105
- H 3.70175700 2.02893500 10.84822800
106
- H 3.98998200 2.68818200 11.00864200
107
- H 19.61345400 10.74535100 22.22723700
108
- H 19.65167500 10.72936900 22.96323800
109
- H 21.15335200 11.20594200 26.99475000
110
- H 21.53029400 10.81346000 27.49202900
111
- H 20.09434500 6.25424400 17.87873800
112
- H 20.01076700 6.21479100 18.61008800
113
- H 3.69537200 12.39851000 8.93646700
114
- H 4.09765200 11.81750500 9.14627000
115
- H 22.83093000 16.73250700 24.19709400
116
- H 23.31256100 17.17900100 23.86229600
117
- H 3.36198000 12.89766000 23.38943200
118
- H 3.45885500 13.00681500 24.11200700
119
- H 2.04611800 15.71757800 8.59329600
120
- H 1.43234600 15.77875600 8.18961900
121
- H 6.12945900 15.14026700 20.02887800
122
- H 6.02278200 14.57365100 20.48820400
123
- H 5.08911400 27.18139700 2.77337500
124
- H 5.06662100 27.18501900 3.51018800
125
- H 14.70758200 4.01177700 13.31696800
126
- H 14.89664300 4.24570600 12.64395500
127
- H 3.65814300 29.03356400 14.88286700
128
- H 3.73378000 28.95725100 14.15357400
129
- H 16.99951200 11.42586000 13.86881500
130
- H 17.03417100 11.12538100 13.19656200
131
- H 2.06797500 18.08136200 13.54583400
132
- H 1.48136600 18.09474000 13.99206700
133
- H 14.60250500 7.57683000 5.97130200
134
- H 15.33793200 7.61271900 6.00698800
135
- H 26.83711700 3.23048000 3.03884500
136
- H 26.55008700 3.90471800 3.11903900
137
- H 22.99777600 19.34731400 20.31560600
138
- H 22.45982800 19.77772100 20.57785400
139
- H 16.41966600 2.80599400 11.89128000
140
- H 16.56901900 2.08412200 11.88831400
141
- H 11.73017700 14.43811800 22.41741700
142
- H 11.12423500 14.82954800 22.56917700
143
- H 17.38249100 23.87139500 12.76358200
144
- H 17.38350900 23.82842900 12.02767000
145
- H 1.00061100 21.01224200 1.31470000
146
- H 1.44321900 21.03360900 1.90381400
147
- H 8.09004900 6.72936800 0.99999800
148
- H 8.19345600 7.35764200 1.37147100
149
- H 3.89822700 15.37766400 9.73104000
150
- H 4.54288400 15.70539800 9.87394700
151
- H 22.22552500 28.69576500 19.77030500
152
- H 21.65346500 29.00000300 19.41873800
153
- H 4.65573400 15.45943800 27.22827700
154
- H 5.35397400 15.56981400 27.43730400
155
- H 12.98406500 8.83317400 11.91500600
156
- H 12.47937800 9.06790600 11.43167900
157
- H 21.24968700 1.72985200 23.51877400
158
- H 21.91940400 2.02865000 23.44385400
159
- H 11.59386400 22.25408800 27.15665400
160
- H 11.73855200 21.54498900 27.29686000
161
- H 21.77510800 4.83204700 19.45360300
162
- H 21.74760500 4.86959100 18.71790800
163
- H 28.68304100 9.21677300 24.30293500
164
- H 28.79634600 9.49180700 23.62844900
165
- H 18.79159300 1.71351500 2.69284300
166
- H 18.77465700 2.18174600 3.26195300
167
- H 19.17586000 13.02896000 14.86997500
168
- H 19.71644200 13.51755200 14.75833800
169
- H 6.02966400 25.52593900 10.73507600
170
- H 5.80325300 25.22399900 10.10184400
171
- H 7.38506300 1.43983700 15.49859600
172
- H 6.79506700 1.06865500 15.73847300
173
- H 27.58382000 24.42158300 19.38106600
174
- H 27.42251200 25.04349100 19.01964600
175
- H 9.93092500 22.73321600 10.93929900
176
- H 10.22059100 22.24094300 11.40531900
177
- H 15.50084100 11.06308800 6.45439200
178
- H 15.87813400 11.34578600 5.88769500
179
- H 16.10016600 28.54356000 2.40068100
180
- H 16.19875700 27.92618400 2.01011700
181
- H 17.12622300 9.66589700 8.78315600
182
- H 16.48701000 9.96416700 8.99729500
183
- H 25.00042100 21.05189700 28.69399300
184
- H 25.35829500 20.90402200 28.06671900
185
- H 11.72392500 14.35901600 14.78824400
186
- H 11.48529200 14.43413500 14.09482800
187
- H 27.80088200 28.99951400 23.03485400
188
- H 27.35755700 28.41175300 23.07244700
189
- H 2.81120100 21.97327000 6.33202600
190
- H 3.02278700 22.64853600 6.53857400
191
- H 11.16091600 21.16245100 20.56587100
192
- H 10.97600400 21.57060200 19.98052200
193
- H 25.63314200 8.24689800 11.42146200
194
- H 25.84695500 7.98978900 10.76450500
195
- H 5.21035300 25.88590800 28.03985400
196
- H 4.61973200 25.44924700 28.10235800
197
- H 14.83558600 10.14445700 28.76566400
198
- H 14.45468700 10.77548600 28.75415200
199
- H 24.19325000 21.19802200 21.61625300
200
- H 24.60150400 21.42553100 22.18632500
201
- H 3.38383900 29.00000600 6.51473400
202
- H 3.38610800 28.83091700 7.23224200
203
- H 17.13203800 26.72357300 21.49248700
204
- H 17.08711600 27.41871500 21.25129500
205
- H 21.43007400 22.30567900 19.46406700
206
- H 20.99498700 21.73213800 19.30543700
207
- H 19.31644700 11.15485400 16.07821400
208
- H 19.68199100 11.18838700 16.71748400
209
- H 10.93924200 5.99489900 26.27955500
210
- H 10.41495800 5.47711900 26.30060500
211
- H 14.95008000 15.52212300 7.01442400
212
- H 14.72471900 15.69369600 7.69500400
213
- H 18.99727600 22.68120300 25.90377400
214
- H 19.40957700 23.25149200 25.68424600
215
- H 8.88447900 1.79024300 17.17555900
216
- H 8.86324600 1.77770600 17.91231200
217
- H 12.15121200 1.54535800 11.42100700
218
- H 11.71339400 1.67546500 11.99962700
219
- H 2.22952700 10.78313900 28.21835700
220
- H 2.22169400 10.63858800 27.49554500
221
- H 4.71118900 24.88843500 6.95444600
222
- H 4.75449800 25.06231100 6.23939000
223
- H 1.28060100 1.44032300 19.29701200
224
- H 1.83528100 1.36120500 18.81796700
225
- H 12.45357900 9.77922200 25.48060700
226
- H 11.74916000 9.99016300 25.53267400
227
- H 8.23385400 11.13248500 18.56147300
228
- H 8.05531600 10.83169400 19.21036700
229
- H 24.48638300 19.81957100 23.69282200
230
- H 25.13594000 19.58627200 23.95178100
231
- H 26.70376200 9.82401100 27.55103500
232
- H 26.90704500 9.33315600 28.06206400
233
- H 8.00838700 4.22559800 18.28897400
234
- H 8.42532000 3.95184600 17.74616600
235
- H 14.94452000 3.51127400 4.84402200
236
- H 14.89449900 3.42688600 5.57463200
237
- H 19.83606200 2.22162900 13.82277900
238
- H 20.02512800 2.59599500 13.21654700
239
- H 6.67903100 3.41714500 3.27561700
240
- H 5.96308500 3.29632200 3.40304000
241
- H 3.40442700 8.43161300 18.68125100
242
- H 3.47980300 8.38947800 19.41334200
243
- H 11.59437400 13.32368500 26.26415800
244
- H 12.23470100 13.62606800 26.46899700
245
- H 14.10053700 2.78998700 1.85965400
246
- H 14.21152000 2.83848100 2.58680300
247
- H 20.73807400 13.46815700 24.67708300
248
- H 21.38650500 13.80030400 24.56470100
249
- H 20.60974700 10.79901200 13.69614100
250
- H 20.72497000 10.71348400 14.41920500
251
- H 3.17495000 22.77164300 26.22314900
252
- H 3.62633300 22.80052800 25.64105600
253
- H 28.64961800 27.52039100 17.72169200
254
- H 28.65554600 27.60539900 18.45391600
255
- H 7.29178200 28.18007600 2.36813400
256
- H 7.28037500 28.22151000 3.10404600
257
- H 6.81956500 10.50511700 4.98278800
258
- H 6.16534900 10.84336000 4.95106300
259
- O 28.65774000 26.05310300 1.73187800
260
- O 27.82042800 25.18551200 1.41787100
261
- O 7.89599500 15.38902200 14.65745800
262
- O 7.88882100 15.60518500 13.43041800
263
- O 11.37704800 22.17970800 3.53597600
264
- O 10.62568400 23.16642300 3.65535900
265
- O 13.21571800 10.10612800 5.39037400
266
- O 13.81380800 10.31472700 4.31744300
267
- O 12.93699800 12.19119900 15.32963100
268
- O 13.36779300 11.62125600 16.35040800
269
- O 27.62157300 9.98656400 1.83057900
270
- O 26.68111300 10.54405800 1.23296700
271
- O 6.77274700 17.50780000 1.73044000
272
- O 5.79918400 17.87923300 1.04734400
273
- O 26.06597600 11.96086100 28.39447800
274
- O 26.32478700 12.75375600 27.46887600
275
- O 1.16753100 1.35249300 15.49177600
276
- O 1.18059100 1.20596000 14.25453600
277
- O 15.08210300 17.91068800 23.23158100
278
- O 15.17178200 18.46551400 22.11958700
279
- O 18.60542300 22.96513600 18.41436700
280
- O 19.71179100 23.45867400 18.70553300
281
- O 1.55709700 26.18859700 1.16408800
282
- O 2.61399600 26.49796400 1.74689400
283
- O 13.99292900 14.15190600 21.10355700
284
- O 14.04751700 14.18255600 19.85917400
285
- O 10.38541200 18.23372400 12.93027500
286
- O 9.91188600 17.49941400 12.04203600
287
- O 24.58403200 25.06294600 21.97592600
288
- O 25.05025500 26.20923800 21.83081500
289
- O 12.79523200 10.91568200 21.34176200
290
- O 12.59216100 11.07454900 22.56074900
291
- O 7.88339000 21.12603300 4.34091800
292
- O 8.23639900 20.09896500 3.73024400
293
- O 14.29669600 11.48202900 10.12026500
294
- O 14.65658800 11.78505600 8.96655000
295
- O 24.45593800 10.09229400 18.89934500
296
- O 23.27212000 10.31487400 19.21783900
297
- O 10.14103800 28.74148400 8.55297800
298
- O 9.09630200 28.47275800 9.17645200
299
- O 6.53750100 18.89849400 13.13483400
300
- O 7.18188100 19.75253500 12.49624700
301
- O 5.99854200 21.81797900 5.25108200
302
- O 5.99224800 23.06318800 5.20840100
303
- O 9.03156900 6.67285800 22.94269500
304
- O 7.94989000 6.26883900 23.41082700
305
- O 11.37806100 15.86060900 17.89431700
306
- O 10.58973300 15.69880900 16.94312500
307
- O 18.69252800 21.49332500 14.52289300
308
- O 19.04391300 21.05544000 13.41060100
309
- O 10.88775200 25.62526500 15.90813900
310
- O 10.56171400 25.66761900 17.10993500
311
- O 5.83323700 6.64702500 10.08718000
312
- O 5.78880400 6.30641500 8.88950900
313
- O 7.71126200 8.59122800 18.86977200
314
- O 7.73147600 8.60812400 17.62409400
315
- O 20.74284900 2.12287500 21.37159100
316
- O 20.54629600 2.47368100 20.19230800
317
- O 9.33194100 10.52852700 15.25052100
318
- O 8.99841100 9.39518300 14.85467600
319
- O 15.28732400 14.68259500 9.86397700
320
- O 14.24814200 15.19621500 10.32081500
321
- O 8.79509800 2.36395800 13.47414000
322
- O 8.02117200 2.64244400 12.53825000
323
- O 22.07041200 27.82260300 11.86453400
324
- O 22.47004200 27.29076900 10.81103700
325
- O 25.64900400 10.71424900 24.59372700
326
- O 25.14662500 10.86773900 25.72353300
327
- O 17.46952600 13.14388400 17.59581300
328
- O 17.02295500 12.33034400 16.76446800
329
- O 12.27907200 3.72064200 4.88171600
330
- O 12.34240900 3.77544700 3.63857800
331
- O 19.50544800 19.26652500 26.41877500
332
- O 19.46811300 19.42938700 27.65347700
333
- O 16.09394700 23.74355500 8.66223700
334
- O 16.43146400 24.61823500 7.84161300
335
- O 12.88585100 27.95040100 27.15844000
336
- O 13.33429000 28.28825200 28.27072000
337
- O 17.90265700 22.35366300 6.91603700
338
- O 18.19323300 21.88298700 5.79959800
339
- O 23.38376600 4.75998600 8.13216000
340
- O 23.39868600 4.98386700 9.35774600
341
- O 16.75294800 1.89397000 5.04381400
342
- O 17.32240900 2.99348800 5.18231300
343
- O 17.56519600 7.26680100 21.77071000
344
- O 18.31705700 8.25843700 21.83209000
345
- O 11.99835900 11.23426800 18.12324800
346
- O 12.36029500 11.59229700 19.26044800
347
- O 7.58959900 13.32747400 11.00503600
348
- O 6.37218600 13.53282600 10.83727300
349
- O 18.59862600 24.35057600 9.30150100
350
- O 18.94728500 24.62991400 8.13839600
351
- O 23.48008200 18.54852600 17.99906900
352
- O 23.36944900 17.83172600 16.98597300
353
- O 22.77455400 28.18135800 14.92714700
354
- O 23.86580000 27.65620500 14.63422500
355
- O 20.78948500 3.67260900 1.83948100
356
- O 21.56215500 3.51027100 2.80334500
357
- O 9.05637000 15.36340100 27.31637100
358
- O 10.18282500 14.88236800 27.54465200
359
- O 5.36124000 14.96264300 23.52556700
360
- O 4.24760100 14.87097200 22.97437700
361
- O 22.64266600 13.26344800 26.40413500
362
- O 22.64331400 14.50641200 26.49043800
363
- O 1.32756400 12.17561700 20.06774300
364
- O 2.10349400 12.35107600 21.02667600
365
- O 1.18281700 3.80763100 4.94719100
366
- O 1.01891800 2.82667000 5.69769700
367
- O 12.59019600 17.94027500 24.45964400
368
- O 12.50958200 18.08831700 23.22514300
369
- O 9.77496800 21.51131100 7.49102600
370
- O 10.45743600 20.53412700 7.85400700
371
- O 1.69369700 6.90651400 3.72886700
372
- O 1.19082500 6.11102100 4.54539400
373
- O 26.88872500 10.54198400 11.12473400
374
- O 27.32702000 10.28414700 9.98727000
375
- O 1.72700700 26.73221500 14.58446600
376
- O 2.56724200 25.91897900 15.01465200
377
- O 10.15694600 18.69534200 19.15618300
378
- O 9.99999700 19.29683100 20.23599100
379
- O 1.99644200 10.71276900 12.34430700
380
- O 2.09478800 10.26022600 13.50100000
381
- O 2.90497500 4.19153100 2.82131400
382
- O 1.84632400 4.84452600 2.74877200
383
- O 5.05591600 16.45745000 12.34283200
384
- O 6.13192000 15.97608900 11.93920500
385
- O 6.49320100 16.95653500 24.96253500
386
- O 6.59211000 17.17298400 26.18555300
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
 
combustion/chgnet/H256O128.extxyz → stability/RM24.db RENAMED
@@ -1,3 +1,3 @@
1
  version https://git-lfs.github.com/spec/v1
2
- oid sha256:0bd0a558f8bc0663b2b079f9ffc33ca44f99fe2fac88a116c5cef5b1f0a0d7dc
3
- size 29022983
 
1
  version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4fe93aebfea70030f9c5f09dd3eba04764b4bc4fd0ee7da1ebeb420540819dcb
3
+ size 28184576
combustion/escn/H256O128.extxyz → stability/RM24.json.gz RENAMED
@@ -1,3 +1,3 @@
1
  version https://git-lfs.github.com/spec/v1
2
- oid sha256:b0f3cc6d42491d8b6f91db52a428c5b5358b5bdd77f28983a1b082258e66809a
3
- size 39859943
 
1
  version https://git-lfs.github.com/spec/v1
2
+ oid sha256:4d8bb548e622cdba5b7f2a2fac7e2d427d4c7df838063fa832c0b398fd43a0b6
3
+ size 14756337