./Stage_1/DOS POSCAR output for 1023: Optical_BPADAODA_6_geofrom953_RPA_true
Status:
finished
Optical_BPADAODA_6_geofrom953_RPA_true
1.0
17.56232992 0.00000000 0.00000000
0.00000000 17.56232992 0.00000000
0.00000000 0.00000000 17.56232992
C H N O
258 170 12 42
Direct
0.98965009 0.09401061 0.81520303 # 1 Untitled_1::C1
0.00741399 0.16976227 0.80218705 # 2 Untitled_1::C2
0.03750575 0.19540530 0.73448967 # 3 Untitled_1::C3
0.00561418 0.03819736 0.76197504 # 4 Untitled_1::C4
0.04179341 0.06358620 0.69515748 # 5 Untitled_1::C5
0.05472871 0.14062305 0.68015850 # 6 Untitled_1::C6
0.00254576 0.21241286 0.87337268 # 7 Untitled_1::C7
0.96323242 0.08814865 0.89461882 # 8 Untitled_1::C8
0.01933871 0.96372686 0.60837691 # 9 Untitled_1::C9
0.05032871 0.91025683 0.55862690 # 10 Untitled_1::C10
0.00264994 0.85503414 0.52747803 # 11 Untitled_1::C11
0.94141312 0.96651587 0.62236903 # 12 Untitled_1::C12
0.89508574 0.91105615 0.59081612 # 13 Untitled_1::C13
0.92427289 0.85364507 0.54422942 # 14 Untitled_1::C14
0.86872202 0.79909892 0.50580958 # 15 Untitled_1::C15
0.84661482 0.83437289 0.42900557 # 16 Untitled_1::C16
0.77178144 0.83201424 0.40264000 # 17 Untitled_1::C17
0.75266033 0.85829267 0.33056100 # 18 Untitled_1::C18
0.90044048 0.86913030 0.38153903 # 19 Untitled_1::C19
0.88284243 0.89346677 0.30807516 # 20 Untitled_1::C20
0.80864559 0.88447567 0.28080200 # 21 Untitled_1::C21
0.79312942 0.87879432 0.13945339 # 22 Untitled_1::C22
0.74905317 0.90788456 0.08216680 # 23 Untitled_1::C23
0.74927763 0.87546371 0.00793528 # 24 Untitled_1::C24
0.82365161 0.80241319 0.13097489 # 25 Untitled_1::C25
0.84046371 0.78169397 0.05070972 # 26 Untitled_1::C26
0.79139887 0.81204451 0.99272157 # 27 Untitled_1::C27
0.79773627 0.78504738 0.55583571 # 28 Untitled_1::C28
0.90614194 0.72199022 0.48823100 # 29 Untitled_1::C29
0.89770278 0.74441130 0.01380450 # 30 Untitled_1::C30
0.81326616 0.77915268 0.91881675 # 31 Untitled_1::C31
0.89716744 0.66520137 0.89422462 # 32 Untitled_1::C32
0.86792214 0.65211509 0.82063885 # 33 Untitled_1::C33
0.88182024 0.58297512 0.78390371 # 34 Untitled_1::C34
0.94148482 0.60769126 0.92858300 # 35 Untitled_1::C35
0.95766859 0.54036774 0.88976787 # 36 Untitled_1::C36
0.92790210 0.52755940 0.81747535 # 37 Untitled_1::C37
0.90826976 0.39400353 0.79584040 # 38 Untitled_1::C38
0.88711086 0.37590497 0.86986562 # 39 Untitled_1::C39
0.85314564 0.30583370 0.88532416 # 40 Untitled_1::C40
0.89517908 0.34143206 0.73792693 # 41 Untitled_1::C41
0.85769466 0.27315288 0.75328794 # 42 Untitled_1::C42
0.83546575 0.25488583 0.82721859 # 43 Untitled_1::C43
0.14588712 0.13795637 0.98774096 # 44 Untitled_2::C1
0.16132935 0.13892876 0.06496131 # 45 Untitled_2::C2
0.19931937 0.20141686 0.09532205 # 46 Untitled_2::C3
0.16366441 0.19570352 0.93783218 # 47 Untitled_2::C4
0.20712707 0.25547329 0.96639162 # 48 Untitled_2::C5
0.22317034 0.25908949 0.04582433 # 49 Untitled_2::C6
0.14165359 0.06339087 0.09626421 # 50 Untitled_2::C7
0.12529081 0.06071441 0.96462110 # 51 Untitled_2::C8
0.23491673 0.31712124 0.84316090 # 52 Untitled_2::C9
0.21720198 0.26116220 0.78895631 # 53 Untitled_2::C10
0.20458029 0.28101764 0.71305700 # 54 Untitled_2::C11
0.25003476 0.39020719 0.81633031 # 55 Untitled_2::C12
0.23278865 0.40990678 0.74159974 # 56 Untitled_2::C13
0.20603061 0.35710427 0.68853014 # 57 Untitled_2::C14
0.16085214 0.38486022 0.61724217 # 58 Untitled_2::C15
0.19194929 0.35769608 0.53909419 # 59 Untitled_2::C16
0.22915310 0.40879954 0.49004681 # 60 Untitled_2::C17
0.27724516 0.38472332 0.43128202 # 61 Untitled_2::C18
0.19178301 0.28118017 0.51446796 # 62 Untitled_2::C19
0.23928688 0.25590253 0.45562043 # 63 Untitled_2::C20
0.28850804 0.30715579 0.41952170 # 64 Untitled_2::C21
0.42031459 0.27646688 0.39004245 # 65 Untitled_2::C22
0.44801176 0.29378311 0.46253324 # 66 Untitled_2::C23
0.52469821 0.28534988 0.48249219 # 67 Untitled_2::C24
0.47124938 0.25288150 0.33348966 # 68 Untitled_2::C25
0.54662727 0.24315814 0.35436465 # 69 Untitled_2::C26
0.57401573 0.25887557 0.42714678 # 70 Untitled_2::C27
0.15417575 0.47194355 0.61857051 # 71 Untitled_2::C28
0.08095955 0.35448030 0.63650201 # 72 Untitled_2::C29
0.61229728 0.22330946 0.30568239 # 73 Untitled_2::C30
0.65781337 0.25519846 0.42546467 # 74 Untitled_2::C31
0.75483846 0.22846560 0.32165154 # 75 Untitled_2::C32
0.76901627 0.22551448 0.24320663 # 76 Untitled_2::C33
0.84258448 0.22423434 0.21376350 # 77 Untitled_2::C34
0.81781436 0.23261792 0.37036969 # 78 Untitled_2::C35
0.89099452 0.23185373 0.34079216 # 79 Untitled_2::C36
0.90428097 0.22704600 0.26316582 # 80 Untitled_2::C37
0.99220338 0.20668294 0.16572117 # 81 Untitled_2::C38
0.98544316 0.13199523 0.14189260 # 82 Untitled_2::C39
0.98157444 0.11543201 0.06441958 # 83 Untitled_2::C40
0.00963167 0.26200728 0.11273205 # 84 Untitled_2::C41
0.00333265 0.24718373 0.03555943 # 85 Untitled_2::C42
0.98395786 0.17405411 0.01028395 # 86 Untitled_2::C43
0.10028297 0.44291519 0.12065067 # 87 Untitled_3::C1
0.06149731 0.42397173 0.05411490 # 88 Untitled_3::C2
0.09721156 0.41762589 0.98439193 # 89 Untitled_3::C3
0.17523402 0.46749033 0.12041851 # 90 Untitled_3::C4
0.20508088 0.47677553 0.04722493 # 91 Untitled_3::C5
0.17028878 0.44593124 0.98239255 # 92 Untitled_3::C6
0.98130816 0.41846909 0.07091646 # 93 Untitled_3::C7
0.04479639 0.43958207 0.18351396 # 94 Untitled_3::C8
0.23614471 0.57441931 0.97493928 # 95 Untitled_3::C9
0.16931074 0.61638318 0.98259537 # 96 Untitled_3::C10
0.14045796 0.65414714 0.91948321 # 97 Untitled_3::C11
0.26716961 0.56172194 0.90411923 # 98 Untitled_3::C12
0.23626139 0.59716361 0.84070236 # 99 Untitled_3::C13
0.17602851 0.64847737 0.84804955 # 100 Untitled_3::C14
0.15761168 0.70340065 0.78287277 # 101 Untitled_3::C15
0.21025674 0.77170706 0.80153679 # 102 Untitled_3::C16
0.19453969 0.81699795 0.86520272 # 103 Untitled_3::C17
0.23925322 0.87918443 0.88526235 # 104 Untitled_3::C18
0.27742692 0.78925314 0.76211423 # 105 Untitled_3::C19
0.32334493 0.85132912 0.78196200 # 106 Untitled_3::C20
0.30406366 0.89761451 0.84314411 # 107 Untitled_3::C21
0.41068413 0.96228634 0.90203789 # 108 Untitled_3::C22
0.44526902 0.02892068 0.93245194 # 109 Untitled_3::C23
0.49515689 0.02464867 0.99436776 # 110 Untitled_3::C24
0.44236244 0.89252250 0.91731172 # 111 Untitled_3::C25
0.49946233 0.88938352 0.97236341 # 112 Untitled_3::C26
0.51978586 0.95284855 0.01768871 # 113 Untitled_3::C27
0.07262380 0.72519295 0.78335353 # 114 Untitled_3::C28
0.17251488 0.66859475 0.70387922 # 115 Untitled_3::C29
0.54275052 0.82787326 0.99817323 # 116 Untitled_3::C30
0.56762112 0.92534701 0.08036571 # 117 Untitled_3::C31
0.63718309 0.78893303 0.09194606 # 118 Untitled_3::C32
0.64025110 0.71335563 0.04967966 # 119 Untitled_3::C33
0.69105215 0.65886087 0.08727743 # 120 Untitled_3::C34
0.67644443 0.79791730 0.15721777 # 121 Untitled_3::C35
0.74793286 0.75541270 0.17447152 # 122 Untitled_3::C36
0.74254892 0.67558860 0.14587240 # 123 Untitled_3::C37
0.01347623 0.80204914 0.03295583 # 124 Untitled_3::C38
0.02869993 0.83816485 0.96432184 # 125 Untitled_3::C39
0.06582944 0.90770423 0.96484579 # 126 Untitled_3::C40
0.03723002 0.83494171 0.10055021 # 127 Untitled_3::C41
0.07499387 0.90419336 0.10215406 # 128 Untitled_3::C42
0.08788194 0.94282197 0.03361616 # 129 Untitled_3::C43
0.92181108 0.30319843 0.54336171 # 130 Untitled_4::C1
0.97408880 0.26303887 0.49966540 # 131 Untitled_4::C2
0.02392844 0.30220721 0.45192966 # 132 Untitled_4::C3
0.92415654 0.38069564 0.55244444 # 133 Untitled_4::C4
0.97931474 0.41880260 0.51060183 # 134 Untitled_4::C5
0.02377165 0.38165398 0.45517133 # 135 Untitled_4::C6
0.95473337 0.18115837 0.50650607 # 136 Untitled_4::C7
0.86125770 0.25204778 0.56838053 # 137 Untitled_4::C8
0.98662221 0.53960991 0.46573439 # 138 Untitled_4::C9
0.91931825 0.53654404 0.42436336 # 139 Untitled_4::C10
0.91639479 0.57210909 0.35461564 # 140 Untitled_4::C11
0.04913334 0.58147827 0.44282855 # 141 Untitled_4::C12
0.04561403 0.61627943 0.37175206 # 142 Untitled_4::C13
0.98088301 0.60970363 0.32646033 # 143 Untitled_4::C14
0.97202675 0.65232118 0.25229196 # 144 Untitled_4::C15
0.04505399 0.69230300 0.23045439 # 145 Untitled_4::C16
0.09183869 0.66165621 0.17376028 # 146 Untitled_4::C17
0.15805149 0.69852843 0.15204436 # 147 Untitled_4::C18
0.06776101 0.76038636 0.26541786 # 148 Untitled_4::C19
0.13406855 0.79833626 0.24381738 # 149 Untitled_4::C20
0.17834884 0.76644773 0.18655053 # 150 Untitled_4::C21
0.29935940 0.74794935 0.20861062 # 151 Untitled_4::C22
0.29784057 0.75511260 0.28793168 # 152 Untitled_4::C23
0.32777108 0.69862134 0.33391727 # 153 Untitled_4::C24
0.33580312 0.68836424 0.17059648 # 154 Untitled_4::C25
0.36452624 0.63190322 0.21771596 # 155 Untitled_4::C26
0.35995146 0.63701768 0.29680438 # 156 Untitled_4::C27
0.90791814 0.70765569 0.27113177 # 157 Untitled_4::C28
0.94433911 0.60177086 0.18662787 # 158 Untitled_4::C29
0.39862881 0.55732541 0.19905561 # 159 Untitled_4::C30
0.39610060 0.57010137 0.33037991 # 160 Untitled_4::C31
0.48489112 0.47405104 0.27511276 # 161 Untitled_4::C32
0.52884295 0.45746337 0.21092816 # 162 Untitled_4::C33
0.60059309 0.42521707 0.21813883 # 163 Untitled_4::C34
0.51063867 0.44998414 0.34679866 # 164 Untitled_4::C35
0.58305626 0.41981018 0.35393152 # 165 Untitled_4::C36
0.62952769 0.41048074 0.29038399 # 166 Untitled_4::C37
0.76322841 0.40076485 0.26186899 # 167 Untitled_4::C38
0.82784983 0.42139858 0.30246017 # 168 Untitled_4::C39
0.89677578 0.43153893 0.26599060 # 169 Untitled_4::C40
0.76736862 0.39047237 0.18355558 # 170 Untitled_4::C41
0.83616035 0.40182904 0.14702919 # 171 Untitled_4::C42
0.90149669 0.42152447 0.18749743 # 172 Untitled_4::C43
0.38346586 0.56510883 0.73046670 # 173 Untitled_5::C1
0.38881106 0.63734823 0.69840064 # 174 Untitled_5::C2
0.37373356 0.64568388 0.62008132 # 175 Untitled_5::C3
0.37040028 0.50001649 0.69038847 # 176 Untitled_5::C4
0.36411881 0.50696682 0.61142975 # 177 Untitled_5::C5
0.36003347 0.57955274 0.57704546 # 178 Untitled_5::C6
0.42103568 0.68617565 0.75956730 # 179 Untitled_5::C7
0.40546183 0.56636954 0.81058765 # 180 Untitled_5::C8
0.39242880 0.37766251 0.60722770 # 181 Untitled_5::C9
0.46205106 0.38238250 0.64428284 # 182 Untitled_5::C10
0.49047988 0.31994487 0.68393880 # 183 Untitled_5::C11
0.35274270 0.30954267 0.60604021 # 184 Untitled_5::C12
0.38440779 0.24615484 0.64043293 # 185 Untitled_5::C13
0.45315290 0.24987059 0.68042762 # 186 Untitled_5::C14
0.48085721 0.17840134 0.72130350 # 187 Untitled_5::C15
0.42094702 0.16833781 0.78411659 # 188 Untitled_5::C16
0.42276624 0.21379636 0.85027545 # 189 Untitled_5::C17
0.37479008 0.19873518 0.91184472 # 190 Untitled_5::C18
0.35879044 0.11947172 0.77484714 # 191 Untitled_5::C19
0.30726087 0.10741319 0.83393327 # 192 Untitled_5::C20
0.32277541 0.13890990 0.90537362 # 193 Untitled_5::C21
0.31442234 0.06954815 0.02893425 # 194 Untitled_5::C22
0.29047543 0.99430271 0.03718135 # 195 Untitled_5::C23
0.30640845 0.95060975 0.10097839 # 196 Untitled_5::C24
0.35671478 0.10564915 0.08566642 # 197 Untitled_5::C25
0.37296221 0.06118323 0.14851344 # 198 Untitled_5::C26
0.34916211 0.98610670 0.15724143 # 199 Untitled_5::C27
0.56083985 0.18502829 0.75665349 # 200 Untitled_5::C28
0.48364450 0.11278454 0.66284082 # 201 Untitled_5::C29
0.42366182 0.08092119 0.21196303 # 202 Untitled_5::C30
0.38372934 0.95600345 0.22756626 # 203 Untitled_5::C31
0.48638156 0.00312195 0.31370345 # 204 Untitled_5::C32
0.47473296 0.95393370 0.37536482 # 205 Untitled_5::C33
0.53306820 0.94242570 0.42764276 # 206 Untitled_5::C34
0.55673760 0.03867576 0.30359443 # 207 Untitled_5::C35
0.61464565 0.02914396 0.35667508 # 208 Untitled_5::C36
0.60169275 0.98176771 0.41933648 # 209 Untitled_5::C37
0.71089325 0.02198141 0.49093618 # 210 Untitled_5::C38
0.78109769 0.01802024 0.45470840 # 211 Untitled_5::C39
0.84002753 0.06478007 0.47809912 # 212 Untitled_5::C40
0.69772314 0.07489503 0.54851808 # 213 Untitled_5::C41
0.75606489 0.12342264 0.57101549 # 214 Untitled_5::C42
0.82722063 0.11927891 0.53467124 # 215 Untitled_5::C43
0.77723319 0.06911069 0.12169558 # 216 Untitled_6::C1
0.80717675 0.03838798 0.05443541 # 217 Untitled_6::C2
0.76834570 0.04195411 0.98556891 # 218 Untitled_6::C3
0.70518607 0.10165980 0.12245805 # 219 Untitled_6::C4
0.66706057 0.10584533 0.05281859 # 220 Untitled_6::C5
0.69626097 0.07521756 0.98502201 # 221 Untitled_6::C6
0.87468700 0.99128552 0.07544998 # 222 Untitled_6::C7
0.82818850 0.04777194 0.18687757 # 223 Untitled_6::C8
0.61490125 0.22442608 0.03406568 # 224 Untitled_6::C9
0.55799375 0.27847760 0.04650978 # 225 Untitled_6::C10
0.57286516 0.35502730 0.03062841 # 226 Untitled_6::C11
0.68584504 0.24645840 0.00580607 # 227 Untitled_6::C12
0.69894448 0.32232595 0.99119440 # 228 Untitled_6::C13
0.64442217 0.37813872 0.00320767 # 229 Untitled_6::C14
0.66637436 0.45869157 0.97844716 # 230 Untitled_6::C15
0.65635589 0.46025879 0.89247059 # 231 Untitled_6::C16
0.71814247 0.44435628 0.84552342 # 232 Untitled_6::C17
0.71074355 0.43968556 0.76704856 # 233 Untitled_6::C18
0.58497059 0.47114516 0.85912228 # 234 Untitled_6::C19
0.57618742 0.46696760 0.78045652 # 235 Untitled_6::C20
0.63986206 0.45330972 0.73489945 # 236 Untitled_6::C21
0.62098035 0.51492504 0.61521525 # 237 Untitled_6::C22
0.58163834 0.57768350 0.64571549 # 238 Untitled_6::C23
0.56189446 0.63915023 0.59940026 # 239 Untitled_6::C24
0.64767041 0.51499934 0.53955600 # 240 Untitled_6::C25
0.62869771 0.57733785 0.49574359 # 241 Untitled_6::C26
0.58367979 0.63662938 0.52374072 # 242 Untitled_6::C27
0.74791501 0.47967141 0.00258738 # 243 Untitled_6::C28
0.61258406 0.51436633 0.01465464 # 244 Untitled_6::C29
0.64818558 0.59504686 0.41570776 # 245 Untitled_6::C30
0.56305411 0.68712596 0.46027573 # 246 Untitled_6::C31
0.58505919 0.68038226 0.31897216 # 247 Untitled_6::C32
0.59955940 0.62825405 0.26083826 # 248 Untitled_6::C33
0.57163650 0.64133912 0.18821084 # 249 Untitled_6::C34
0.54651989 0.74853030 0.30136621 # 250 Untitled_6::C35
0.51884992 0.76156064 0.22858358 # 251 Untitled_6::C36
0.53133572 0.70764207 0.17184347 # 252 Untitled_6::C37
0.54966877 0.69701994 0.03566269 # 253 Untitled_6::C38
0.50678215 0.62522018 0.02156391 # 254 Untitled_6::C39
0.45667300 0.61034056 0.96622292 # 255 Untitled_6::C40
0.53951039 0.75099354 0.96828773 # 256 Untitled_6::C41
0.47789128 0.73918671 0.91195885 # 257 Untitled_6::C42
0.44111440 0.66600943 0.90442921 # 258 Untitled_6::C43
0.04789794 0.25566925 0.72657680 # 259 Untitled_1::H1
0.99413517 0.97805135 0.77204373 # 260 Untitled_1::H3
0.08025440 0.15480340 0.62547417 # 261 Untitled_1::H5
0.02756137 0.81424182 0.48762545 # 262 Untitled_1::H6
0.11056431 0.91447839 0.54360456 # 263 Untitled_1::H7
0.91629678 0.01192857 0.65618774 # 264 Untitled_1::H9
0.83408126 0.91479083 0.60103439 # 265 Untitled_1::H10
0.69362307 0.85851483 0.31194571 # 266 Untitled_1::H11
0.72651206 0.81226338 0.43975845 # 267 Untitled_1::H12
0.95845453 0.87794703 0.40194913 # 268 Untitled_1::H13
0.92860532 0.91783067 0.27450527 # 269 Untitled_1::H14
0.71030186 0.89787892 0.96568224 # 270 Untitled_1::H15
0.70614165 0.94848859 0.09962341 # 271 Untitled_1::H16
0.87152951 0.79225927 0.16754383 # 272 Untitled_1::H17
0.81388632 0.76898594 0.61415607 # 273 Untitled_1::H18
0.76344586 0.73851788 0.53185847 # 274 Untitled_1::H19
0.76070528 0.83537426 0.55898824 # 275 Untitled_1::H20
0.95497734 0.72810975 0.44983616 # 276 Untitled_1::H21
0.86531990 0.68423406 0.45979749 # 277 Untitled_1::H22
0.92632059 0.69401866 0.54037625 # 278 Untitled_1::H23
0.85637941 0.57129404 0.72833806 # 279 Untitled_1::H24
0.83132934 0.69471453 0.79414600 # 280 Untitled_1::H25
0.96236941 0.61439775 0.98655307 # 281 Untitled_1::H26
0.99255593 0.49722370 0.91727125 # 282 Untitled_1::H27
0.84285065 0.29004806 0.94437600 # 283 Untitled_1::H28
0.89902233 0.41487907 0.91592737 # 284 Untitled_1::H29
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