Melting Temperature Fit
Download MPFit Figure
| Method / sample set | ΔH | ΔS estimate |
|---|---|---|
| uMLIP (PBE sample set) |
0.759276 ± 0.0402 eV/atom
73.259 ± 3.88 kJ/mol of atoms
|
0.000199951 ± 1.19e-05
eV/(atom K)
19.2923 ± 1.15 J/(mol of atoms K)
|
| PBE |
0.709742 ± 0.0399 eV/atom
68.4797 ± 3.85 kJ/mol of atoms
|
Inherited from matched uMLIP estimate
19.2923 ± 1.15 J/(mol of atoms K)
|
| uMLIP (R2SCAN sample set) |
0.759276 ± 0.0402 eV/atom
73.259 ± 3.88 kJ/mol of atoms
|
0.000199951 ± 1.19e-05
eV/(atom K)
19.2923 ± 1.15 J/(mol of atoms K)
|
| R2SCAN |
0.768135 ± 0.0431 eV/atom
74.1138 ± 4.16 kJ/mol of atoms
|
Inherited from matched uMLIP estimate
19.2923 ± 1.15 J/(mol of atoms K)
|
ΔH is the liquid-minus-solid value reported by the existing correction workflow. Each uMLIP row uses the sample set matched to that DFT method. Uncertainties are standard errors; — means unavailable.
ΔS is estimated as ΔHuMLIP/Tm,uMLIP. Its propagated uncertainty assumes these two quantities are independent. The current PBE/R2SCAN correction inherits this entropy estimate; it is not an independently calculated DFT entropy.
| Sample set | Cp,solid | Cp,liquid |
|---|---|---|
| uMLIP (PBE sample set) |
— J/(mol of atoms K)
— eV/(atom K)
|
— J/(mol of atoms K)
— eV/(atom K)
|
| uMLIP (R2SCAN sample set) |
— J/(mol of atoms K)
— eV/(atom K)
|
— J/(mol of atoms K)
— eV/(atom K)
|
Values reported in SLUSCHI.out by the correction workflow. These are uMLIP potential-energy–temperature slopes for the PBE/R2SCAN sample sets, not full thermodynamic heat capacities or independent DFT heat capacities. The workflow may substitute the other phase's slope when one is unavailable. Uncertainties are not reported; — means unavailable.
| Vsolid [ų/atom] | Vliquid [ų/atom] | ΔV [ų/atom] |
|---|---|---|
| 13.8858 ± 0.117 | 14.9313 ± 0.238 | 1.04554 ± 0.225 |
=======================================================================================================
Solid and Liquid in Ultra Small Coexistence with Hovering Interfaces (SLUSCHI)
Developed and maintained by Qi-Jun Hong, with early research support from Axel van de Walle (2014-2020)
=======================================================================================================
Generating solid with radius = 11
*** Generate a supercell from the current unitcell ***
The supercell is:
6.8854963276949999 6.8854963276949999 0.0000000000000000
9.1806617702590003 -9.1806617702590003 0.0000000000000000
2.2951654425650001 -2.2951654425650001 -9.1806617702590003
|a|,|b|,|c|,theta(bc),theta(ac),theta(ab):
9.738 12.983 9.738 70.529 90.000 90.000
In UNIT-cell, number of atoms: 8 8 16 total: 32
Inverse Matrix is:
7.2616406458440558E-002 5.4462304843836351E-002 0.0000000000000000
7.2616406458440558E-002 -5.4462304843836351E-002 0.0000000000000000
0.0000000000000000 2.7231152421921142E-002 -0.10892460968767270
In SUPER-cell, number of atoms: 24 24 48 total: 96
POSCAR_STRCT atoms = 96
Accepted radius = 11 with 96 atoms
====================================================================================================
=== SLUSCHI fit-first-1-guard1; source: /data/qhong7/qhong7/sluschi_lammps/src/ ===
/data/qhong7/qhong7/sluschi_auto/7ed7788f-d6f8-4f03-abbd-26f04fd1612a/Zr8Ta8C16/Dir_lammps
['Zr', 'Ta', 'C']
elements: ['Zr', 'Ta', 'C']
counts: [24, 24, 48]
solid atom IDs: 1:96
liquid atom IDs: 97:192
Original Tm = 1000.0
New temp = 500
New temp_end = 2000
500, 2000, 1
Adaptive temp step = 500
500 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 500/1, step_param=1000
Pressure trial 1: scale=1.0
Pressure = -11098.78173
Pressure trial 2: scale=0.995
Pressure = 20370.669
Pressure trial 3: scale=0.9974999999999999
Pressure = 4261.043071
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
500 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
1000 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 1000/1, step_param=1000
Pressure trial 1: scale=0.9974999999999999
Pressure = 30121.7138
Pressure trial 2: scale=1.0074999999999998
Pressure = -35759.9299
Pressure trial 3: scale=1.0025
Pressure = -4139.682431
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
1000 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
1500 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 1500/1, step_param=1000
Pressure trial 1: scale=1.0025
Pressure = 20052.88792
Pressure trial 2: scale=1.0125
Pressure = -39487.0414
Pressure trial 3: scale=1.0075
Pressure = -701.755502
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
1500 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
2000 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 2000/1, step_param=1000
Pressure trial 1: scale=1.0075
Pressure = 80453.6616
Pressure trial 2: scale=1.0175
Pressure = 35507.3424
Pressure trial 3: scale=1.0275
Pressure = -25365.86963
Pressure trial 4: scale=1.0225000000000002
Pressure = -6124.30714
Pressure trial 5: scale=1.0175000000000003
Pressure = 8651.84429
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
2000 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
500, 500, 1
Adaptive temp step = 100
500 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
1000, 1000, 1
Adaptive temp step = 100
1000 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
1500, 1500, 1
Adaptive temp step = 100
1500 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
2000, 2000, 1
Adaptive temp step = 100
2000 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
Wrote summary.csv and summary.out for 4 trajectories
Wrote phase_pred.csv: {'solid': 4}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
=== running MPFit ===
Melting temperature and std error: 2044.9288524999999 6630.6399410254917
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
=== Find next job to run ===
next job: 1 MD duplicate(s) at 2800.0 K
2800, 2800, 1
Adaptive temp step = 100
2800 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 2800/1, step_param=1000
Pressure trial 1: scale=1.0175000000000003
Pressure = 108284.5604
Pressure trial 2: scale=1.0275000000000003
Pressure = 55221.99008
Pressure trial 3: scale=1.0375000000000003
Pressure = 24551.85673
Pressure trial 4: scale=1.0475000000000003
Pressure = -14095.68923
Pressure trial 5: scale=1.0425000000000004
Pressure = 3370.34516
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
2800 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
Wrote summary.csv and summary.out for 5 trajectories
Wrote phase_pred.csv: {'solid': 5}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
=== running MPFit ===
Melting temperature and std error: 2859.9890240000004 9754.8747285353111
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
2800 1 0 1
=== Find next job to run ===
next job: 1 MD duplicate(s) at 3600.0 K
3600, 3600, 1
Adaptive temp step = 100
3600 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 3600/1, step_param=1000
Pressure trial 1: scale=1.0425000000000004
Pressure = 35433.5568
Pressure trial 2: scale=1.0525000000000004
Pressure = -5870.382267
Pressure trial 3: scale=1.0475000000000005
Pressure = 7746.08784
Pressure trial 4: scale=1.0500000000000005
Pressure = 9013.36323
Pressure trial 5: scale=1.0525000000000004
Pressure = -1912.53423
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
3600 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
Wrote summary.csv and summary.out for 6 trajectories
Wrote phase_pred.csv: {'solid': 6}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
=== running MPFit ===
Melting temperature and std error: 3687.3237335999997 12721.452554402069
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
2800 1 0 1
3600 1 0 1
=== Find next job to run ===
next job: 1 MD duplicate(s) at 4400.0 K
4400, 4400, 1
Adaptive temp step = 100
4400 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 4400/1, step_param=1000
Pressure trial 1: scale=1.0525000000000004
Pressure = 23003.6718
Pressure trial 2: scale=1.0625000000000004
Pressure = -7070.30755
Pressure trial 3: scale=1.0575000000000006
Pressure = 16961.14529
Pressure trial 4: scale=1.0600000000000005
Pressure = 283.585689
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: liquid
4400 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
Initial scan stopped at 4400 K: confirmed liquid. Fitting before further MD.
Wrote summary.csv and summary.out for 7 trajectories
Wrote phase_pred.csv: {'solid': 6, 'liquid': 1}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
FIT NOW: reporting the partial batch before further MD.
=== running MPFit ===
Melting temperature and std error: 3690.3093469999999 17736.802880183121
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
2800 1 0 1
3600 1 0 1
4400 0 1 1
=== Find next job to run ===
next job: 1 MD duplicate(s) at 4000.0000000000000 K
4000, 4000, 1
Adaptive temp step = 100
4000 K: 0/1 usable completed; 0 genuinely resolved; no replacement attempts
Starting NEW trajectory 4000/1, step_param=1000
Pressure trial 1: scale=1.0600000000000005
Pressure = -10792.24069
Pressure trial 2: scale=1.0550000000000006
Pressure = 3409.85277
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: liquid
4000 K: 1/1 usable completed; 1 genuinely resolved; no replacement attempts
Wrote summary.csv and summary.out for 8 trajectories
Wrote phase_pred.csv: {'solid': 6, 'liquid': 2}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
=== running MPFit ===
Melting temperature and std error: 3712.0509952000002 17740.341268458760
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
2800 1 0 1
3600 1 0 1
4000 0 1 1
4400 0 1 1
=== Find next job to run ===
next job: 4 MD duplicate(s) at 3600.0000000000000 K
next job: 4 MD duplicate(s) at 4000.0000000000000 K
3600, 3600, 4
Adaptive temp step = 100
3600 K: 1/4 usable completed; 1 genuinely resolved; no replacement attempts
Starting NEW trajectory 3600/2, step_param=1100
Pressure trial 1: scale=1.0525000000000004
Pressure = -5138.74118
Pressure trial 2: scale=1.0475000000000005
Pressure = 6767.31222
Pressure trial 3: scale=1.0500000000000005
Pressure = 16824.02021
Pressure trial 4: scale=1.0525000000000004
Pressure = -3216.364101
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
3600 K: 2/4 usable completed; 2 genuinely resolved; no replacement attempts
Starting NEW trajectory 3600/3, step_param=1200
Pressure trial 1: scale=1.0525000000000004
Pressure = -1117.76797
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
3600 K: 3/4 usable completed; 3 genuinely resolved; no replacement attempts
Starting NEW trajectory 3600/4, step_param=1300
Pressure trial 1: scale=1.0525000000000004
Pressure = -7623.383401
Pressure trial 2: scale=1.0475000000000005
Pressure = 22564.15817
Pressure trial 3: scale=1.0500000000000005
Pressure = 5797.79922
Pressure trial 4: scale=1.0525000000000004
Pressure = 6401.92191
Pressure trial 5: scale=1.0550000000000004
Pressure = -24284.34953
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: solid
3600 K: 4/4 usable completed; 4 genuinely resolved; no replacement attempts
4000, 4000, 4
Adaptive temp step = 100
4000 K: 1/4 usable completed; 1 genuinely resolved; no replacement attempts
Starting NEW trajectory 4000/2, step_param=1100
Pressure trial 1: scale=1.0550000000000006
Pressure = 2141.61155
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: liquid
4000 K: 2/4 usable completed; 2 genuinely resolved; no replacement attempts
Starting NEW trajectory 4000/3, step_param=1200
Pressure trial 1: scale=1.0550000000000006
Pressure = 2201.0371
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: liquid
4000 K: 3/4 usable completed; 3 genuinely resolved; no replacement attempts
Starting NEW trajectory 4000/4, step_param=1300
Pressure trial 1: scale=1.0550000000000006
Pressure = 27351.5341
Pressure trial 2: scale=1.0650000000000006
Pressure = -17065.002429
Pressure trial 3: scale=1.0600000000000007
Pressure = 1327.30992
Production: at most 8 blocks of 10000 steps, including the first
Completed! Phase: liquid
4000 K: 4/4 usable completed; 4 genuinely resolved; no replacement attempts
Wrote summary.csv and summary.out for 14 trajectories
Wrote phase_pred.csv: {'solid': 9, 'liquid': 5}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
=== running MPFit ===
Melting temperature and std error: 3797.3153937005318 105.48902577323932
500 1 0 1
1000 1 0 1
1500 1 0 1
2000 1 0 1
2800 1 0 1
3600 4 0 4
4000 0 4 4
4400 0 1 1
current fit
1 3797.3153937005318 105.48902577323932
possibilities:
current fit
0 3797.3153937005318 105.48902577323932
possibilities:
MP accuracy achieved. Stopping code...
summary.out
======================================================================================================================================================
folder poteng [eV/atom] kineng [eV/atom] temp [K] volume [Ang^3/atom] press [bar] energy_slope energy_dir diffusion [cm^2/s] spg phase left_phase right_phase left_D [cm^2/s] right_D [cm^2/s] phase_reason last_md_step phase_check
1000/1 -10.325459 0.128014 995.544965 12.385418 -1585.000763 0.00000057 up 0.00000000e+00 P1 (1) solid solid solid 0.00000000e+00 0.00000000e+00 Both original halves agree 11100 RESOLVED
1500/1 -10.258496 0.195007 1516.539110 12.554644 -5434.120118 0.00000045 up 1.26202094e-09 P1 (1) solid solid solid 0.00000000e+00 5.85659615e-09 Both original halves agree 11100 RESOLVED
2000/1 -10.144413 0.257509 2002.606425 12.655506 23311.899330 -0.00002083 down 8.42425455e-08 P1 (1) solid solid solid 1.11300521e-07 3.71223283e-08 Both original halves agree 11100 RESOLVED
2800/1 -10.003391 0.363081 2823.622310 13.080335 1565.785750 -0.00004466 down 7.83331330e-08 P1 (1) solid solid solid 1.67121731e-07 0.00000000e+00 Both original halves agree 11100 RESOLVED
3600/1 -9.830145 0.469472 3651.007580 13.584980 -17497.393255 -0.00004509 down 0.00000000e+00 P1 (1) solid solid solid 0.00000000e+00 0.00000000e+00 Both original halves agree 11100 RESOLVED
3600/2 -9.722424 0.471072 3663.453330 14.032067 -37673.490340 -0.00004479 down 3.88440931e-07 P1 (1) solid solid solid 0.00000000e+00 5.87367179e-07 Both original halves agree 11200 RESOLVED
3600/3 -9.761104 0.471523 3666.956500 13.906129 -34805.450300 -0.00004753 down 0.00000000e+00 P1 (1) solid solid solid 0.00000000e+00 0.00000000e+00 Both original halves agree 11300 RESOLVED
3600/4 -9.713837 0.472348 3673.377990 13.889453 -15221.806509 -0.00003752 down 0.00000000e+00 P1 (1) solid solid solid 0.00000000e+00 0.00000000e+00 Both original halves agree 11400 RESOLVED
4000/1 -9.099221 0.504568 3923.946755 15.025769 26944.328965 0.00004508 up 4.68369483e-05 P1 (1) liquid liquid liquid 4.36951820e-05 4.99787145e-05 Both original halves agree 11100 RESOLVED
4000/2 -9.070592 0.498458 3876.425580 15.174998 26731.610329 0.00004625 up 7.05633498e-05 P1 (1) liquid liquid liquid 5.05275077e-05 7.34521601e-05 Both original halves agree 11200 RESOLVED
4000/3 -9.030272 0.505264 3929.357270 15.444249 10556.932575 0.00003111 up 7.36761157e-05 P1 (1) liquid liquid liquid 9.01337715e-05 5.62803597e-05 Both original halves agree 11300 RESOLVED
4000/4 -9.035148 0.501744 3901.982965 15.356786 17802.248102 0.00003545 up 6.31208433e-05 P1 (1) liquid liquid liquid 4.61331129e-05 7.25639048e-05 Both original halves agree 11400 RESOLVED
4400/1 -8.952587 0.557704 4337.173285 15.880273 6724.086190 0.00001932 up 1.28110771e-04 P1 (1) liquid liquid liquid 8.73644535e-05 1.68857088e-04 Both original halves agree 11100 RESOLVED
500/1 -10.392960 0.064540 501.918159 12.231363 1111.759539 0.00000021 up 0.00000000e+00 P1 (1) solid solid solid 0.00000000e+00 7.12516457e-09 Both original halves agree 11100 RESOLVED
======================================================================================================================================================
Wrote summary.csv and summary.out for 14 trajectories
Wrote phase_pred.csv: {'solid': 9, 'liquid': 5}
Wrote jobs_results.out (weighted counts); 0 unresolved trajectories
Wrote /data/qhong7/qhong7/sluschi_auto/7ed7788f-d6f8-4f03-abbd-26f04fd1612a/Zr8Ta8C16/Dir_lammps/cost_table.out
Collected 59 log files
====================================
Computational cost summary:
Number of trajectories (temp/id) = 14
Total log files (incl. subruns) = 59
Total wall time = 2:15:49
Total seconds = 8149
Total GPU hours = 2.26
====================================
=== DFT corrections begin ===
=== PBE correction ===
PBE_METHOD = PBE
N rows with PBE energy = 8
MT_LMP = 3797.315393700532
STD_LMP = 105.48902577323932
SOLID (PBE present only):
lammps_poteng_eV_per_atom = -9.79687982
PBE_energy_eV_per_atom = -9.85669187
N_solid_PBE = 4
SEM_lammps_solid_PBE = 3.45575974e-02 eV/atom
SEM_PBE_solid = 3.36650672e-02 eV/atom
LIQUID (PBE present only):
lammps_poteng_eV_per_atom = -9.03760352
PBE_energy_eV_per_atom = -9.14694952
N_liquid_PBE = 4
SEM_lammps_liquid_PBE = 2.04835766e-02 eV/atom
SEM_PBE_liquid = 2.13317432e-02 eV/atom
DH_LMP_raw_PBE = 0.75927630 eV/atom
DH_LMP_PBE = 0.75927630 eV/atom
DH_PBE = 0.70974234 eV/atom
STD_DH_LMP_PBE = 4.01721850e-02 eV/atom
STD_DH_PBE = 3.98544856e-02 eV/atom
COV_DH_PBE_LMP = 1.58498812e-03 (eV/atom)^2
DH_raw_PBE = 0.70974234 eV/atom
MT_PBE = 3549.58467498 K
STD_PBE = 102.98889752 K
=== R2SCAN correction ===
N rows with R2SCAN energy = 8
MT_LMP = 3797.315393700532
STD_LMP = 105.48902577323932
SOLID (R2SCAN present only):
lammps_poteng_eV_per_atom = -9.79687982
R2SCAN_energy_eV_per_atom = -23.05727827
N_solid_R2SCAN = 4
SEM_lammps_solid_R2SCAN = 3.45575974e-02 eV/atom
SEM_R2SCAN_solid = 3.64418469e-02 eV/atom
LIQUID (R2SCAN present only):
lammps_poteng_eV_per_atom = -9.03760352
R2SCAN_energy_eV_per_atom = -22.28914300
N_liquid_R2SCAN = 4
SEM_lammps_liquid_R2SCAN = 2.04835766e-02 eV/atom
SEM_R2SCAN_liquid = 2.30789792e-02 eV/atom
DH_LMP_raw_R2SCAN = 0.75927630 eV/atom
DH_LMP_R2SCAN = 0.75927630 eV/atom
DH_R2SCAN = 0.76813527 eV/atom
STD_DH_LMP_R2SCAN = 4.01721850e-02 eV/atom
STD_DH_R2SCAN = 4.31352233e-02 eV/atom
COV_DH_R2SCAN_LMP = 1.71750482e-03 (eV/atom)^2
DH_raw_R2SCAN = 0.76813527 eV/atom
MT_R2SCAN = 3841.62113250 K
STD_R2SCAN = 110.99835201 K
=== DFT corrections end ===
ZrTaC2 ATAT rocksalt B1 SQS; equiatomic cations, full C 1.0 -2.295165442565 2.295165442565 9.180661770259 -2.295165442565 -2.295165442565 0.000000000000 9.180661770259 -9.180661770259 0.000000000000 Zr Ta C 8 8 16 Direct 0.250000000000 0.500000000000 0.187500000000 0.250000000000 0.500000000000 0.437500000000 0.750000000000 0.500000000000 0.312500000000 0.000000000000 0.000000000000 0.500000000000 0.000000000000 0.000000000000 0.750000000000 0.750000000000 0.500000000000 0.062500000000 0.500000000000 0.000000000000 0.125000000000 0.500000000000 0.000000000000 0.875000000000 0.250000000000 0.500000000000 0.687500000000 0.250000000000 0.500000000000 0.937500000000 0.000000000000 0.000000000000 0.250000000000 0.750000000000 0.500000000000 0.562500000000 0.750000000000 0.500000000000 0.812500000000 0.000000000000 0.000000000000 0.000000000000 0.500000000000 0.000000000000 0.375000000000 0.500000000000 0.000000000000 0.625000000000 0.000000000000 0.500000000000 0.125000000000 0.000000000000 0.500000000000 0.375000000000 0.000000000000 0.500000000000 0.625000000000 0.000000000000 0.500000000000 0.875000000000 0.500000000000 0.500000000000 0.250000000000 0.750000000000 0.000000000000 0.187500000000 0.500000000000 0.500000000000 0.500000000000 0.750000000000 0.000000000000 0.437500000000 0.500000000000 0.500000000000 0.750000000000 0.750000000000 0.000000000000 0.687500000000 0.500000000000 0.500000000000 0.000000000000 0.750000000000 0.000000000000 0.937500000000 0.250000000000 0.000000000000 0.062500000000 0.250000000000 0.000000000000 0.312500000000 0.250000000000 0.000000000000 0.562500000000 0.250000000000 0.000000000000 0.812500000000
No output files have been received yet.