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As4Eu3_9
Solved Structure
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Energy-R2 Fit
Open PNGRun Summary
FormulaAs4Eu3
Crystal Systemmonoclinic
Input SG9
Solved SG15
R20.9901
Chi20.3587
Rwp/Wr9.7478
Statusbest_result
Valid Structures1421
Candidates30
Total Time12h 18m 39.8s
Search Details
Phase 1 SGs16
Phase 2 Pairs13
Refined Structures82
Refine Failures117
More than one attempt reached and Stop further generation.
Log Preview
ID 1335-26: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.687, -7.621, 0.019, 0.074 ID 1336-27: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.685, -7.621, 0.019, 0.085 Refinement failed; continuing search without refined metrics. ID 1337-29: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.788, -7.494, 0.022, 0.059 [refine-failed] ID 1338-34: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.732, -7.604, 0.017, 0.069 ID 1339-35: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.724, -7.570, 0.013, 0.093 ID 1340-37: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.648, -7.601, 0.019, 0.069 ID 1341-39: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.715, -7.578, 0.007, 0.089 ID 1342-40: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.738, -7.147, 0.018, 0.091 ID 1343-41: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.716, -7.579, 0.007, 0.077 ID 1344-43: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.602, -3.165, 0.018, 0.135 ID 1345-45: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.656, -7.592, 0.018, 0.096 Refinement failed; continuing search without refined metrics. ID 1346-51: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.878, -7.617, 0.007, 0.076 [refine-failed] ID 1347-52: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.681, -7.605, 0.017, 0.071 ID 1348-53: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.702, -7.513, 0.016, 0.099 Refinement failed; continuing search without refined metrics. ID 1349-55: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.812, -7.499, 0.018, 0.081 [refine-failed] ID 1350-61: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.701, -3.770, 0.034, 0.086 ID 1351-64: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.676, -7.533, 0.020, 0.085 ID 1352-66: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.726, -7.568, 0.016, 0.079 ID 1353-67: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.753, -7.491, 0.016, 0.075 ID 1354-68: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.729, -7.576, 0.014, 0.088 ID 1355-71: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.755, -7.184, 0.017, 0.098 Refinement failed; continuing search without refined metrics. ID 1356-72: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.876, -7.600, 0.008, 0.074 [refine-failed] Refinement failed; continuing search without refined metrics. ID 1357-73: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.787, -7.400, 0.014, 0.084 [refine-failed] ID 1358-77: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.676, -7.605, 0.016, 0.098 ID 1359-84: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.654, -7.598, 0.019, 0.088 ID 1360-87: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.714, -7.579, 0.007, 0.083 ID 1361-90: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.694, -7.347, 0.005, 0.060 ID 1362-91: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.746, -7.429, 0.004, 0.064 ID 1363-93: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.648, -7.602, 0.019, 0.094 ID 1364-96: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.638, -3.244, 0.004, 0.190 ID 1365-98: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.519, -6.923, 0.004, 0.068 ID 1366-99: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.748, -7.185, 0.016, 0.080 ID 1367-101: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.627, -7.549, 0.019, 0.079 ID 1368-103: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.781, -3.610, 0.005, 0.092 83.001, 0.281, 26.008, -38.0, 54.2s ID 1369-106: * 28 14 12 C2/m 6.90 8j 4i 4i 4i 4h 2b 2a , vol=727.4 ų 0.642, -7.602, 0.019, 0.040 WP #6: spg=12, count=1, dof=9, n_wps=7, wyckoff=[['8j', '4i', '4i'], ['4i', '4f', '2c', '2a']] ID 1370-1: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.633, -7.862, 0.017, 0.067 ID 1371-3: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.719, -7.651, 0.022, 0.086 ID 1372-4: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.427, -6.924, 0.107, 0.083 ID 1373-5: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.649, -7.675, 0.028, 0.053 ID 1374-7: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.711, -7.651, 0.022, 0.085 ID 1375-13: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.623, -7.594, 0.016, 0.066 ID 1376-15: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.629, -7.871, 0.017, 0.097 ID 1377-18: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.667, -7.402, 0.025, 0.067 ID 1378-21: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.647, -7.674, 0.028, 0.079 ID 1379-23: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.585, -7.720, 0.035, 0.085 ID 1380-25: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.627, -7.862, 0.016, 0.092 ID 1381-28: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.573, -7.633, 0.013, 0.079 ID 1382-33: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.591, -7.622, 0.035, 0.397 ID 1383-35: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.629, -7.863, 0.017, 0.099 ID 1384-36: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.668, -0.805, 0.040, 0.322 ID 1385-37: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.645, -7.675, 0.029, 0.061 ID 1386-39: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.489, -6.463, 0.053, 0.090 ID 1387-40: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.620, -7.871, 0.017, 0.067 ID 1388-44: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.595, -7.148, 0.064, 0.072 ID 1389-46: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.554, -7.657, 0.019, 0.078 ID 1390-47: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.607, -7.707, 0.000, 0.079 ID 1391-49: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.526, -7.352, 0.014, 0.082 ID 1392-51: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.528, -7.008, 0.052, 0.081 ID 1393-52: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.755, -7.678, 0.018, 0.078 ID 1394-54: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.396, -0.527, 0.019, 0.152 ID 1395-55: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.646, -7.675, 0.027, 0.064 ID 1396-57: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.491, -7.175, 0.023, 0.111 ID 1397-58: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.553, -7.634, 0.031, 0.084 ID 1398-59: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.624, -3.498, 0.063, 0.079 ID 1399-61: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.650, -7.675, 0.028, 0.062 ID 1400-62: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.588, -7.655, 0.020, 0.176 ID 1401-63: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.483, -6.815, 0.021, 0.084 ID 1402-64: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.561, -7.634, 0.032, 0.069 ID 1403-65: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.615, -7.699, 0.023, 0.084 ID 1404-67: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.671, -7.404, 0.079, 0.219 ID 1405-69: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.595, -7.655, 0.021, 0.079 ID 1406-70: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.662, -7.707, 0.002, 0.055 ID 1407-72: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.615, -7.706, 0.001, 0.179 ID 1408-73: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.634, -7.679, 0.011, 0.253 ID 1409-84: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.595, -7.708, 0.003, 0.068 ID 1410-85: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.577, -7.634, 0.012, 0.094 ID 1411-89: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.554, -7.674, 0.033, 0.094 ID 1412-90: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.455, -7.270, 0.027, 0.040 ID 1413-91: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.494, -6.712, 0.050, 0.079 ID 1414-92: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.596, -7.484, 0.029, 0.092 ID 1415-93: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.623, -7.870, 0.017, 0.091 ID 1416-95: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.530, -7.689, 0.033, 0.384 ID 1417-96: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.546, -6.843, 0.031, 0.081 ID 1418-97: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.472, -7.146, 0.024, 0.081 ID 1419-100: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.581, -7.438, 0.064, 0.060 ID 1420-102: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.582, -7.712, 0.034, 0.325 ID 1421-103: * 28 13 12 C2/m 6.90 8j 4i 4i 4i 4f 2c 2a , vol=727.4 ų 0.705, -7.746, 0.016, 0.086 More than one attempt reached and Stop further generation. Timing breakdown: 1) SPG + cell inference: 12m 23.1s 2) Structure inference: 12h 6m 16.7s Total: 12h 18m 39.8s No acceptance; return best result in spg=15 Best inferred-SG score observed: -2.4857