1.0 Version
**************************************************
The number of configurations
--------------------------------------------------
13
**************************************************
The maximum number of atom type
--------------------------------------------------
1
**************************************************
The atom types in the data file
--------------------------------------------------
Si
**************************************************
The maximum number of atoms per system
--------------------------------------------------
16
**************************************************
The maximum number of atoms per atom type
--------------------------------------------------
16
**************************************************
Reference atomic energy (eV)
--------------------------------------------------
0.0
**************************************************
Atomic mass
--------------------------------------------------
28.085
**************************************************
The numbers of basis sets per atom type
--------------------------------------------------
1
**************************************************
Basis set for Si
--------------------------------------------------
1 1
**************************************************
Configuration num. 1
==================================================
System name
--------------------------------------------------
si-thermal-static
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
0.000000000000000e+00 0.000000000000000e+00 0.000000000000000e+00
0.000000000000000e+00 2.734462955000000e+00 2.734462955000000e+00
2.734462955000000e+00 0.000000000000000e+00 2.734462955000000e+00
2.734462955000000e+00 2.734462955000000e+00 5.468925910000000e+00
2.734462955000000e+00 2.734462955000000e+00 0.000000000000000e+00
2.734462955000000e+00 5.468925910000000e+00 2.734462955000000e+00
5.468925910000000e+00 2.734462955000000e+00 2.734462955000000e+00
5.468925910000000e+00 5.468925910000000e+00 5.468925910000000e+00
1.367231477500000e+00 1.367231477500000e+00 1.367231477500000e+00
1.367231477500000e+00 4.101694432500000e+00 4.101694432500000e+00
4.101694432500000e+00 1.367231477500000e+00 4.101694432500000e+00
4.101694432500000e+00 4.101694432500000e+00 6.836157387500000e+00
4.101694432500000e+00 4.101694432500000e+00 1.367231477500000e+00
4.101694432500000e+00 6.836157387500000e+00 4.101694432500000e+00
6.836157387500000e+00 4.101694432500000e+00 4.101694432500000e+00
6.836157387500000e+00 6.836157387500000e+00 6.836157387500000e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.676904236999999e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
1.420000000000000e-06 4.000000000000000e-08 -2.600000000000000e-07
3.500000000000000e-07 2.000000000000000e-08 7.600000000000000e-07
4.000000000000000e-07 -9.000000000000000e-08 -9.700000000000000e-07
1.000000000000000e-06 1.210000000000000e-06 -7.700000000000000e-07
1.700000000000000e-07 -5.600000000000000e-07 -1.500000000000000e-07
1.180000000000000e-06 -4.000000000000000e-07 1.110000000000000e-06
-1.200000000000000e-07 8.400000000000000e-07 1.830000000000000e-06
2.800000000000000e-07 -7.600000000000000e-07 -1.190000000000000e-06
2.200000000000000e-07 -1.020000000000000e-06 -5.800000000000000e-07
-8.000000000000000e-08 7.800000000000000e-07 5.800000000000000e-07
-4.000000000000000e-08 1.230000000000000e-06 -6.200000000000000e-07
-1.540000000000000e-06 4.700000000000000e-07 3.000000000000000e-08
-9.100000000000000e-07 -3.800000000000000e-07 8.600000000000000e-07
-1.220000000000000e-06 -4.800000000000000e-07 -2.700000000000000e-07
-8.600000000000000e-07 -5.800000000000000e-07 -3.900000000000000e-07
-2.500000000000000e-07 -3.100000000000000e-07 3.000000000000000e-08
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
-9.957000000000001e-02 -9.958000000000000e-02 -9.957000000000001e-02
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
1.000000000000000e-05 3.000000000000000e-05 -3.000000000000000e-05
**************************************************
Configuration num. 2
==================================================
System name
--------------------------------------------------
si-thermal-000-00--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.453728858681292e+00 5.436528321044715e+00 2.211644575855820e-02
5.468423425087390e+00 2.751618866201152e+00 8.159471421129373e+00
2.694880564630452e+00 1.244663550682853e-01 2.740085010835480e+00
2.735182775028274e+00 2.857037389838980e+00 5.577749058773840e+00
2.754779030348986e+00 8.120215470947393e+00 5.446105175962753e+00
2.767346512711648e+00 5.409820001024343e+00 2.737542561869180e+00
5.480882677406292e+00 8.204239118911229e+00 8.138649470133712e+00
5.517712283919042e+00 5.450266098862858e+00 5.450465003698204e+00
1.265033823087607e+00 1.445220931371778e+00 1.327783349261543e+00
1.346439550907585e+00 4.065556699804125e+00 4.132757056640655e+00
4.107936719222933e+00 1.433869628752982e+00 4.180886010976055e+00
4.128010521154106e+00 4.099386162941166e+00 6.877017701786938e+00
4.129226755587232e+00 4.024614296939278e+00 1.394115623488378e+00
4.058670173608994e+00 6.876823336160096e+00 4.082889530758465e+00
6.849775286462195e+00 4.082520542327317e+00 4.012454905828021e+00
6.869081962155973e+00 6.713853555115048e+00 6.815948448409591e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.620410946000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-3.150814300000000e-01 1.622955000000000e-01 -2.152640500000000e-01
-3.805361800000000e-01 5.688241000000000e-02 1.102800810000000e+00
4.142318800000000e-01 -3.403050300000000e-01 -6.780016000000000e-02
-2.781486500000000e-01 -1.561424210000000e+00 -5.722954000000000e-01
-7.600401200000000e-01 1.371472130000000e+00 1.976799600000000e-01
-1.981458700000000e-01 -8.484800000000001e-02 3.080336400000000e-01
5.184068800000000e-01 -1.247406280000000e+00 7.512831100000000e-01
-7.264332500000000e-01 -3.370981400000000e-01 -6.401869500000000e-01
9.608467000000001e-01 -1.027775970000000e+00 -1.092253400000000e-01
2.233789000000000e-01 4.441989600000000e-01 -2.619315000000000e-01
-2.330930400000000e-01 1.461190500000000e-01 -3.489030600000000e-01
-1.916161600000000e-01 1.681520930000000e+00 1.539167500000000e-01
-6.349098399999999e-01 4.767410400000000e-01 -7.796061700000000e-01
1.117544870000000e+00 -1.106740310000000e+00 -3.134227300000000e-01
3.197724400000000e-01 1.581014800000000e-01 5.346781600000000e-01
1.638228500000000e-01 1.208266440000000e+00 2.602429300000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
3.555070000000000e+00 7.729400000000000e-01 3.191510000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-3.121870000000000e+00 6.329840000000000e+00 6.733590000000000e+00
**************************************************
Configuration num. 3
==================================================
System name
--------------------------------------------------
si-thermal-000-00-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.484122961318708e+00 5.501323498955285e+00 1.091573537424144e+01
5.469428394912611e+00 8.186232953798848e+00 2.778380398870627e+00
8.242971255369548e+00 1.081338546493171e+01 8.197766809164520e+00
8.202669044971726e+00 8.080814430161020e+00 5.360102761226161e+00
8.183072789651014e+00 2.817636349052608e+00 5.491746644037248e+00
8.170505307288352e+00 5.528031818975657e+00 8.200309258130821e+00
5.456969142593708e+00 2.733612701088772e+00 2.799202349866289e+00
5.420139536080959e+00 5.487585721137143e+00 5.487386816301797e+00
1.469429131912393e+00 1.289242023628222e+00 1.406679605738458e+00
1.388023404092415e+00 4.137832165195876e+00 4.070631808359346e+00
4.095452145777068e+00 1.300593326247018e+00 4.022502854023946e+00
4.075378343845894e+00 4.104002702058834e+00 6.795297073213062e+00
4.074162109412769e+00 4.178774568060722e+00 1.340347331511622e+00
4.144718691391007e+00 6.795491438839904e+00 4.120499334241535e+00
6.822539488537806e+00 4.120868322672683e+00 4.190933959171980e+00
6.803232812844028e+00 6.958461219884954e+00 6.856366326590409e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.623352848000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
3.224294000000000e-01 -1.404316500000000e-01 2.508937700000000e-01
3.699760300000000e-01 1.473145000000000e-02 -8.207204600000000e-01
-5.739093300000000e-01 3.388149600000000e-01 2.984189500000000e-01
-6.272894000000000e-02 1.428718740000000e+00 5.163288500000000e-01
6.514841800000000e-01 -1.384587550000000e+00 1.917118300000000e-01
2.303166700000000e-01 1.343034000000000e-01 -2.857276500000000e-01
-3.409587400000000e-01 1.093931340000000e+00 -4.987640000000000e-01
7.584467800000000e-01 1.991450600000000e-01 6.855720700000000e-01
-8.630119800000000e-01 9.559997900000000e-01 -1.765284600000000e-01
-2.053740100000000e-01 -5.230871200000000e-01 2.650728800000000e-01
3.088591400000000e-01 -2.142454100000000e-01 2.852338000000000e-01
3.819691100000000e-01 -1.578329740000000e+00 -2.640431900000000e-01
4.333788400000000e-01 -2.549897600000000e-01 6.105525400000000e-01
-1.061455830000000e+00 1.013873700000000e+00 -1.215482000000000e-01
-3.795995600000000e-01 -1.399643000000000e-02 -6.604191300000000e-01
3.017823000000000e-02 -1.069850790000000e+00 -2.760336000000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
2.960930000000000e+00 7.215200000000001e-01 2.854370000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-1.232490000000000e+00 -4.084370000000000e+00 -5.700390000000000e+00
**************************************************
Configuration num. 4
==================================================
System name
--------------------------------------------------
si-thermal-000-01--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.477050163507083e+00 5.474552231597690e+00 1.091215207929595e+01
5.437547892902116e+00 8.161932054964060e+00 2.739413754869287e+00
8.177324128180718e+00 5.446072034271737e+00 2.751552418751346e+00
2.769353553831359e+00 2.721033405846145e+00 5.443746646974805e+00
2.800078909311144e+00 8.074023391412279e+00 5.534742573892041e+00
8.159809127304316e+00 5.493318632100819e+00 8.163822115758554e+00
5.425088257758400e+00 2.721753280563678e+00 2.715173779869135e+00
5.534297075187412e+00 5.407263496918455e+00 5.468186128392154e+00
1.293129883057641e+00 1.445843131072558e+00 1.433920052249872e+00
1.346674113139865e+00 4.200925905566586e+00 4.070331454948369e+00
4.114029594890005e+00 1.347049554903586e+00 4.094561804638919e+00
4.083009956507004e+00 4.156139722815155e+00 6.775561414970904e+00
4.116632584866129e+00 4.215902449792603e+00 1.409042072353059e+00
4.099637460086731e+00 6.805210923345673e+00 4.060299694773137e+00
6.895210521340625e+00 4.068831164503478e+00 4.093345515516535e+00
6.836089572818716e+00 6.825111415014760e+00 6.899111342124451e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.614096714000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
2.392848000000000e-02 6.811309600000000e-01 6.284243000000000e-01
-5.903847200000000e-01 1.851081570000000e+00 3.218032600000000e-01
1.014860600000000e-01 5.535536800000000e-01 -4.612700000000000e-01
-7.504905800000000e-01 3.515501000000000e-01 6.207089000000000e-02
-2.210191100000000e-01 1.522376330000000e+00 -1.735728200000000e-01
4.816196800000000e-01 2.599219000000000e-02 6.826147400000000e-01
4.057337500000000e-01 5.934523600000000e-01 3.813197000000000e-01
-9.970647000000001e-02 7.080497500000000e-01 -3.769752800000000e-01
9.419106300000000e-01 -1.499786270000000e+00 -7.369639100000001e-01
2.464812600000000e-01 -1.657961130000000e+00 1.592039000000000e-01
-3.117101000000000e-01 -6.414880000000000e-03 -1.682036500000000e-01
9.503939000000000e-02 -7.471068700000000e-01 6.193290900000000e-01
-1.214835200000000e-01 -1.425510060000000e+00 -7.503529600000000e-01
3.133846200000000e-01 -5.971269100000000e-01 7.108480400000000e-01
-1.431263200000000e-01 -1.043276610000000e+00 4.794436000000000e-01
-3.716630300000000e-01 6.899958000000000e-01 -1.377718880000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
4.947900000000000e+00 1.171930000000000e+00 3.621850000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-4.115850000000000e+00 1.652650000000000e+00 -2.089089000000000e+01
**************************************************
Configuration num. 5
==================================================
System name
--------------------------------------------------
si-thermal-000-01-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.460801656492918e+00 5.463299588402311e+00 2.569974070404930e-02
5.500303927097884e+00 2.775919765035941e+00 8.198438065130714e+00
2.760527691819283e+00 5.491779785728263e+00 8.186299401248656e+00
8.168498266168642e+00 8.216818414153856e+00 5.494105173025195e+00
8.137772910688858e+00 2.863828428587723e+00 5.403109246107960e+00
2.778042692695685e+00 5.444533187899181e+00 2.774029704241445e+00
5.512763562241600e+00 8.216098539436322e+00 8.222678040130866e+00
5.403554744812588e+00 5.530588323081546e+00 5.469665691607846e+00
1.441333071942359e+00 1.288619823927442e+00 1.300542902750128e+00
1.387788841860135e+00 4.002462959433414e+00 4.133057410051632e+00
4.089359270109996e+00 1.387413400096414e+00 4.108827060361081e+00
4.120378908492997e+00 4.047249142184846e+00 6.896753360029096e+00
4.086756280133872e+00 3.987486415207397e+00 1.325420882646941e+00
4.103751404913270e+00 6.867103851654327e+00 4.143089170226864e+00
6.777104253659375e+00 4.134557700496522e+00 4.110043349483465e+00
6.836225202181285e+00 6.847203359985241e+00 6.773203432875549e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.614217913000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-1.547336800000000e-01 -6.577158500000000e-01 -5.066793400000000e-01
4.280978600000000e-01 -1.659982920000000e+00 -1.209480000000000e-03
-1.320212000000000e-02 -5.163609600000000e-01 4.695085000000000e-01
1.003221350000000e+00 -3.965096300000000e-01 9.025635000000000e-02
3.071135100000000e-01 -1.794524630000000e+00 3.431424500000000e-01
-3.396140800000000e-01 -1.635599500000000e-01 -5.250197900000000e-01
-4.714163500000000e-01 -6.364420200000001e-01 -4.718246400000000e-01
2.476572000000000e-01 -8.187906500000000e-01 5.071529900000000e-01
-5.924762600000000e-01 1.334788830000000e+00 2.513510500000000e-01
-3.226256800000000e-01 1.744583140000000e+00 -3.132338500000000e-01
3.093686500000000e-01 1.368893000000000e-02 1.546827200000000e-01
-3.411067900000000e-01 8.640162400000000e-01 -7.174293300000000e-01
3.978736700000000e-01 1.383287130000000e+00 8.530143300000000e-01
-5.015343500000000e-01 6.876499800000000e-01 -8.308960700000000e-01
-8.377150999999999e-02 1.188167330000000e+00 -5.701854500000000e-01
1.271485800000000e-01 -5.722949700000000e-01 1.267369540000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
4.964600000000000e+00 7.981900000000000e-01 3.770450000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-2.038600000000000e-01 -4.095290000000000e+00 2.345266000000000e+01
**************************************************
Configuration num. 6
==================================================
System name
--------------------------------------------------
si-thermal-300-00--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.419982851353637e+00 5.420274454483159e+00 3.112529803158300e-02
5.450734129542235e+00 2.775935187407007e+00 8.157958606844149e+00
2.679321853241316e+00 2.310042584613722e-01 2.746192269777695e+00
8.205057926498473e+00 8.381880223427258e+00 5.659240922176899e+00
2.747447880477372e+00 8.092682218142757e+00 5.410217974762814e+00
2.789644909635232e+00 5.344117473616044e+00 2.746648651644885e+00
5.510250864232251e+00 8.158332845444169e+00 8.109421615946603e+00
5.545009333813625e+00 5.425638923908277e+00 5.410409879372996e+00
1.208370719248170e+00 1.482452285181876e+00 1.298065315245121e+00
1.334255932454546e+00 4.050925135424511e+00 4.163251076554446e+00
4.100957658801405e+00 1.497057434649344e+00 4.236387843087763e+00
4.133707555963812e+00 4.170557561570206e+00 6.918762177325745e+00
4.135345389895339e+00 3.957413830724230e+00 1.390514718601457e+00
4.058458580865536e+00 6.863065870208677e+00 4.062358745378252e+00
6.874475909091747e+00 4.074123553485104e+00 3.947008050706014e+00
6.903015334885305e+00 6.639501593244528e+00 6.808473684543580e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.588728616000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-3.366418600000000e-01 2.528256100000000e-01 -2.480113100000000e-01
-3.921984500000000e-01 4.626985000000000e-02 1.263642120000000e+00
4.284853500000000e-01 -5.588329900000000e-01 -1.435929000000000e-02
-4.098600000000000e-01 -1.850359230000000e+00 -7.402315500000000e-01
-8.663453900000000e-01 1.530786660000000e+00 2.819319400000000e-01
-2.486044400000000e-01 -9.469660000000000e-03 3.344657800000000e-01
5.397519100000000e-01 -1.340911390000000e+00 9.391296400000000e-01
-8.153531700000000e-01 -3.125913500000000e-01 -6.128976500000000e-01
1.163688510000000e+00 -1.173519870000000e+00 -1.355254100000000e-01
2.996189300000000e-01 4.786736800000000e-01 -2.873124000000000e-01
-1.935964300000000e-01 2.510042000000000e-02 -5.118101100000000e-01
-1.885072600000000e-01 1.844457240000000e+00 7.059563000000001e-02
-7.406372500000000e-01 6.117287400000000e-01 -8.819204500000000e-01
1.238965320000000e+00 -1.269485350000000e+00 -3.601094700000000e-01
3.497981600000000e-01 2.591784200000000e-01 6.276456000000000e-01
1.714360700000000e-01 1.466149230000000e+00 2.747669200000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
2.579910000000000e+00 -1.921880000000000e+00 1.409070000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-4.300130000000000e+00 7.709200000000000e+00 7.764190000000000e+00
**************************************************
Configuration num. 7
==================================================
System name
--------------------------------------------------
si-thermal-300-00-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.517868968646364e+00 5.517577365516842e+00 1.090672652196842e+01
5.487117690457765e+00 8.161916632592993e+00 2.779893213155852e+00
8.258529966758685e+00 1.070684756153863e+01 8.191659550222305e+00
2.732793893501527e+00 2.555971596572744e+00 5.278610897823101e+00
8.190403939522627e+00 2.845169601857243e+00 5.527633845237186e+00
8.148206910364769e+00 5.593734346383957e+00 8.191203168355116e+00
5.427600955767749e+00 2.779518974555831e+00 2.828430204053397e+00
5.392842486186376e+00 5.512212896091723e+00 5.527441940627005e+00
1.526092235751830e+00 1.252010669818124e+00 1.436397639754879e+00
1.400207022545454e+00 4.152463729575490e+00 4.040137788445555e+00
4.102431206198595e+00 1.237405520350656e+00 3.967001021912238e+00
4.069681309036188e+00 4.032831303429794e+00 6.753552597674256e+00
4.068043475104661e+00 4.245975034275770e+00 1.343948236398543e+00
4.144930284134465e+00 6.809248904791323e+00 4.141030119621748e+00
6.797838865908253e+00 4.129265311514897e+00 4.256380814293986e+00
6.769299440114696e+00 7.032813181755472e+00 6.863841090456420e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.594604004999999e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
3.157370200000000e-01 -1.848978800000000e-01 3.063231300000000e-01
3.995325100000000e-01 2.512064000000000e-02 -8.995795900000000e-01
-7.255176000000000e-01 4.688259000000000e-01 3.808084500000000e-01
-2.246592600000000e-01 1.596028060000000e+00 7.589060300000000e-01
7.104627500000000e-01 -1.574966540000000e+00 2.322631400000000e-01
2.868515200000000e-01 8.293439000000000e-02 -2.562466800000000e-01
-3.949875100000000e-01 1.097523200000000e+00 -5.497306800000000e-01
8.119524200000000e-01 1.671206500000000e-01 7.414941800000000e-01
-1.026574930000000e+00 1.106923160000000e+00 -2.786132200000000e-01
-2.123987600000000e-01 -6.265340600000000e-01 2.877719400000000e-01
4.290481800000000e-01 -1.186467200000000e-01 3.635549400000000e-01
4.911856400000000e-01 -1.630041460000000e+00 -2.682668200000000e-01
4.761387300000000e-01 -3.235796100000000e-01 6.547274199999999e-01
-1.176499140000000e+00 1.124692430000000e+00 -2.078417600000000e-01
-3.419638300000000e-01 -1.524193000000000e-02 -8.465891700000000e-01
1.816922700000000e-01 -1.195260230000000e+00 -4.189813000000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
1.188140000000000e+00 -2.135710000000000e+00 5.084300000000000e-01
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-2.442880000000000e+00 -3.235220000000000e+00 -5.250280000000000e+00
**************************************************
Configuration num. 8
==================================================
System name
--------------------------------------------------
si-thermal-300-01--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.481863802714546e+00 5.502335523694931e+00 1.091014503817624e+01
1.086269264466517e+01 8.182995130903093e+00 8.218290320873272e+00
8.158919168990980e+00 5.432417766952240e+00 2.753364766108660e+00
2.764317219960840e+00 2.727991137456624e+00 5.416392118668909e+00
2.849191231214421e+00 8.015570198743980e+00 5.583922054205493e+00
8.138094155396809e+00 5.516624678623320e+00 8.149156808106076e+00
5.409897003501156e+00 2.729052109083164e+00 2.712964771315567e+00
5.587242075057677e+00 5.369299471104195e+00 5.451351188452660e+00
1.260303366243235e+00 1.469672772561683e+00 1.478418788255474e+00
1.330419480928681e+00 4.232505561962772e+00 4.055271564291484e+00
4.106104629043084e+00 1.339749687288177e+00 4.080307924282650e+00
4.068735895814126e+00 4.177400117601021e+00 6.742055165355144e+00
4.123635106979811e+00 4.259044290590674e+00 1.418827730862340e+00
4.116811145297090e+00 6.765248934828713e+00 4.061409175772499e+00
6.949465875858926e+00 4.002021781180254e+00 4.106818652009893e+00
6.826195793644194e+00 6.843033522735902e+00 6.895192473885122e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.588346438000001e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
1.990670000000000e-03 7.141653100000001e-01 7.260866900000000e-01
-6.289041300000000e-01 2.021614270000000e+00 3.557794600000000e-01
1.239010700000000e-01 5.816756600000000e-01 -4.867989500000000e-01
-8.217707600000000e-01 3.944971500000000e-01 1.088590200000000e-01
-3.351415000000000e-01 1.684788810000000e+00 -1.915945000000000e-01
6.030808300000000e-01 -4.243239000000000e-02 7.883420300000000e-01
5.016648100000000e-01 6.339366000000000e-01 4.227728000000000e-01
-2.035418600000000e-01 7.813573900000000e-01 -3.281516700000000e-01
1.209882350000000e+00 -1.674382340000000e+00 -9.724994000000000e-01
2.541603300000000e-01 -1.865506350000000e+00 2.156546800000000e-01
-3.653207600000000e-01 4.036338000000000e-02 -1.742013400000000e-01
1.046819300000000e-01 -8.015884900000000e-01 6.962626200000001e-01
-1.029863600000000e-01 -1.680008940000000e+00 -8.202534200000000e-01
3.259512400000000e-01 -5.499423600000000e-01 7.947241800000000e-01
-2.351682000000000e-01 -1.010002220000000e+00 4.679308400000000e-01
-4.324796500000000e-01 7.714645200000000e-01 -1.602913020000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
4.539330000000000e+00 -7.056000000000000e-02 2.699170000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-5.298110000000000e+00 1.758160000000000e+00 -2.212393000000000e+01
**************************************************
Configuration num. 9
==================================================
System name
--------------------------------------------------
si-thermal-300-01-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.455988017285454e+00 5.435516296305069e+00 2.770678182376020e-02
7.515917533483450e-02 2.754856689096909e+00 2.719561499126728e+00
2.778932651009020e+00 5.505434053047760e+00 8.184487053891340e+00
8.173534600039160e+00 8.209860682543376e+00 5.521459701331092e+00
8.088660588785579e+00 2.922281621256021e+00 5.353929765794508e+00
2.799757664603190e+00 5.421227141376680e+00 2.788695011893924e+00
5.527954816498844e+00 8.208799710916837e+00 8.224887048684433e+00
5.350609744942323e+00 5.568552348895807e+00 5.486500631547340e+00
1.474159588756765e+00 1.264790182438317e+00 1.256044166744527e+00
1.404043474071319e+00 3.970883303037228e+00 4.148117300708517e+00
4.097284235956917e+00 1.394713267711823e+00 4.123080940717351e+00
4.134652969185875e+00 4.025988747398979e+00 6.930259609644856e+00
4.079753758020190e+00 3.944344574409326e+00 1.315635224137660e+00
4.086577719702910e+00 6.907065840171288e+00 4.141979689227502e+00
6.722848899141074e+00 4.201367083819746e+00 4.096570212990108e+00
6.846118981355807e+00 6.829281252264098e+00 6.777122301114878e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.589641190000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-1.358116800000000e-01 -6.557540800000000e-01 -5.284017200000000e-01
3.920688100000000e-01 -1.757345020000000e+00 2.214830000000000e-03
-7.668474000000000e-02 -5.295872200000000e-01 5.124134700000000e-01
1.142142350000000e+00 -4.371461800000000e-01 9.866186000000000e-02
4.976424600000000e-01 -2.043979200000000e+00 5.497343300000000e-01
-4.003802200000000e-01 -1.365840500000000e-01 -5.737864300000000e-01
-5.426949000000000e-01 -6.616316700000000e-01 -4.918661100000000e-01
3.560419500000000e-01 -9.312672000000000e-01 5.904798000000000e-01
-6.866403500000000e-01 1.474927540000000e+00 2.632156700000000e-01
-3.791622700000000e-01 1.966212850000000e+00 -4.033842000000000e-01
3.556453900000000e-01 -4.058050000000000e-02 1.538298100000000e-01
-4.050313800000000e-01 1.000212750000000e+00 -8.251344400000000e-01
3.951727400000000e-01 1.524706020000000e+00 8.927399100000000e-01
-5.519418000000000e-01 6.632223000000000e-01 -9.779284200000000e-01
-6.343670000000000e-02 1.210544490000000e+00 -6.627735800000000e-01
1.030703400000000e-01 -6.459508200000000e-01 1.399985220000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
4.349700000000000e+00 -8.703100000000000e-01 2.785210000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-1.105230000000000e+00 -5.124970000000000e+00 2.534197000000000e+01
**************************************************
Configuration num. 10
==================================================
System name
--------------------------------------------------
si-thermal-600-00--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.397291183967865e+00 5.402134191307466e+00 4.155514132380311e-02
5.440554817745952e+00 2.793237829890324e+00 8.146623437556787e+00
2.660883314846492e+00 3.223035466988351e-01 2.750352809852987e+00
8.205217619135045e+00 8.443173976213210e+00 5.732498497283568e+00
2.747702458978483e+00 8.057871575008202e+00 5.385533977668029e+00
2.810442852046148e+00 5.292684741138413e+00 2.753425471186262e+00
5.530167707989809e+00 8.131424472114011e+00 8.076451485137801e+00
5.571097805771357e+00 5.406246276699195e+00 5.382015762940868e+00
1.150983256171954e+00 1.521795683489157e+00 1.270740155071360e+00
1.322474498812928e+00 4.033861813139016e+00 4.186896415240405e+00
4.098511681688158e+00 1.550511919657385e+00 4.288151609650726e+00
4.143932314534408e+00 4.211043527878605e+00 6.953438886464764e+00
4.145207777435138e+00 3.901175170224668e+00 1.394967736834415e+00
4.048639561908203e+00 6.865669899280724e+00 4.046042587750581e+00
6.892426291159844e+00 4.063982797616486e+00 3.888302740553264e+00
6.930503687808220e+00 6.567845264955049e+00 6.799039951416608e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.524863777000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-4.230375100000000e-01 3.665174200000000e-01 -3.064185900000000e-01
-4.710920100000000e-01 6.321617000000000e-02 1.670547640000000e+00
4.862116200000000e-01 -7.789387100000000e-01 4.321122000000000e-02
-6.403106900000000e-01 -2.352350920000000e+00 -9.969426100000000e-01
-1.144877340000000e+00 1.914773720000000e+00 4.784240200000000e-01
-3.156552700000000e-01 3.361280000000000e-02 4.202006100000000e-01
7.291030500000000e-01 -1.690358130000000e+00 1.271653820000000e+00
-1.004492760000000e+00 -3.672209600000000e-01 -7.121357400000000e-01
1.513519470000000e+00 -1.498677800000000e+00 -2.730264600000000e-01
4.188733200000000e-01 5.666176100000000e-01 -3.399482400000000e-01
-1.944357400000000e-01 -6.674707000000001e-02 -7.000531200000000e-01
-1.736688300000000e-01 2.343996970000000e+00 2.725072000000000e-02
-1.008016380000000e+00 8.427645300000000e-01 -1.150361170000000e+00
1.571015820000000e+00 -1.646263050000000e+00 -5.474018000000000e-01
4.362956800000000e-01 3.984146800000000e-01 7.639649900000000e-01
2.205675600000000e-01 1.870642730000000e+00 3.510347100000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
3.598270000000000e+00 -4.240570000000000e+00 1.199380000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-6.528020000000000e+00 1.019514000000000e+01 9.855890000000000e+00
**************************************************
Configuration num. 11
==================================================
System name
--------------------------------------------------
si-thermal-600-00-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.540560636032136e+00 5.535717628692535e+00 1.089629667867620e+01
5.497297002254048e+00 8.144613990109676e+00 2.791228382443213e+00
8.276968505153508e+00 1.061554827330117e+01 8.187499010147013e+00
2.732634200864955e+00 2.494677843786791e+00 5.205353322716432e+00
8.190149361021518e+00 2.879980244991798e+00 5.552317842331972e+00
8.127408967953853e+00 5.645167078861587e+00 8.184426348813739e+00
5.407684112010193e+00 2.806427347885990e+00 2.861400334862201e+00
5.366754014228643e+00 5.531605543300805e+00 5.555836057059134e+00
1.583479698828047e+00 1.212667271510844e+00 1.463722799928640e+00
1.411988456187072e+00 4.169527051860985e+00 4.016492449759596e+00
4.104877183311843e+00 1.183951035342615e+00 3.915237255349274e+00
4.059456550465593e+00 3.992345337121396e+00 6.718875888535236e+00
4.058181087564863e+00 4.302213694775332e+00 1.339495218165585e+00
4.154749303091797e+00 6.806644875719276e+00 4.157346277249419e+00
6.779888483840156e+00 4.139406067383514e+00 4.315086124446736e+00
6.741811087191780e+00 7.104469510044951e+00 6.873274823583393e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.537392627000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
3.738506500000000e-01 -2.381837700000000e-01 4.034663500000000e-01
4.927253800000000e-01 3.822591000000000e-02 -1.080997750000000e+00
-9.944575300000000e-01 6.018408900000000e-01 5.618583400000000e-01
-4.507638100000000e-01 1.964604060000000e+00 1.064056660000000e+00
8.917612700000001e-01 -1.990268700000000e+00 3.549124100000000e-01
3.757247300000000e-01 8.492457000000000e-02 -2.755139400000000e-01
-5.191511000000000e-01 1.269353620000000e+00 -6.217269700000000e-01
9.859988400000000e-01 1.457968000000000e-01 9.664482400000000e-01
-1.290114090000000e+00 1.389934390000000e+00 -4.091371400000000e-01
-2.488750400000000e-01 -8.132646400000000e-01 3.412478200000000e-01
6.310457300000000e-01 -8.197015000000001e-02 4.411515400000000e-01
6.842583300000000e-01 -1.955445610000000e+00 -3.777709500000000e-01
5.746211500000000e-01 -3.763809900000000e-01 7.783946700000000e-01
-1.476064170000000e+00 1.408233500000000e+00 -3.772653900000000e-01
-3.947925200000000e-01 2.754930000000000e-03 -1.135802600000000e+00
3.642321700000000e-01 -1.450154830000000e+00 -6.333212800000000e-01
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
5.677200000000000e-01 -4.870000000000000e+00 -7.937500000000000e-01
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-4.426400000000000e+00 -2.796910000000000e+00 -5.467580000000000e+00
**************************************************
Configuration num. 12
==================================================
System name
--------------------------------------------------
si-thermal-600-01--1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.487610604750033e+00 5.520340540332870e+00 1.090296504941678e+01
1.082889375282396e+01 8.187008392803627e+00 8.225406159131810e+00
8.141464709124403e+00 5.420545713208295e+00 2.757861699816676e+00
2.769972034662521e+00 2.728216785339671e+00 5.394962843450942e+00
2.893777962237915e+00 7.951505013063875e+00 5.628430798345510e+00
8.114707332838618e+00 5.536375102965435e+00 8.131482223971620e+00
5.389603077302105e+00 2.731161145671097e+00 2.707390677960318e+00
5.633994719498567e+00 5.333767640709888e+00 5.441028153283463e+00
1.222836520483452e+00 1.501464240458363e+00 1.520062307421982e+00
1.317167835934678e+00 4.273092429954210e+00 4.038632575967345e+00
4.105117214470033e+00 1.329304585692668e+00 4.070390409969678e+00
4.056506010247889e+00 4.202549574980006e+00 6.708554931557885e+00
4.130723381851762e+00 4.311881388552735e+00 1.433770313058456e+00
4.126156883406171e+00 6.732858619544888e+00 4.051437409714501e+00
6.995170345959906e+00 3.954007291464151e+00 4.112788148708435e+00
6.820186045650955e+00 6.850884165879708e+00 6.908724838846086e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.530053952000000e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-3.011736000000000e-02 8.605629000000000e-01 9.474050200000000e-01
-8.647102000000000e-01 2.538554720000000e+00 5.221433000000000e-01
1.598458300000000e-01 6.854136500000000e-01 -5.913807500000000e-01
-9.946755400000000e-01 4.822321400000000e-01 1.702327400000000e-01
-4.749469700000000e-01 1.982726610000000e+00 -1.885585900000000e-01
8.406283500000000e-01 -1.553804200000000e-01 1.025076370000000e+00
6.266326100000000e-01 7.611467700000000e-01 4.938060300000000e-01
-2.894905500000000e-01 9.310272000000001e-01 -3.296957300000000e-01
1.710414110000000e+00 -2.122551830000000e+00 -1.398406380000000e+00
2.928425700000000e-01 -2.318936870000000e+00 2.793749000000000e-01
-4.729959100000000e-01 8.757388000000001e-02 -2.179192500000000e-01
1.072340300000000e-01 -9.298473500000000e-01 8.400459400000000e-01
-3.419166000000000e-02 -2.090351400000000e+00 -9.692974300000000e-01
3.812173400000000e-01 -6.053327600000000e-01 9.751898500000000e-01
-3.338469900000000e-01 -1.146165900000000e+00 5.311957600000000e-01
-6.238396500000000e-01 1.039328670000000e+00 -2.089211780000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
6.233230000000000e+00 -6.081700000000000e-01 3.410950000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-7.757690000000000e+00 2.051100000000000e+00 -2.661058000000000e+01
**************************************************
Configuration num. 13
==================================================
System name
--------------------------------------------------
si-thermal-600-01-+1
==================================================
The number of atom types
--------------------------------------------------
1
==================================================
The number of atoms
--------------------------------------------------
16
**************************************************
Atom types and atom numbers
--------------------------------------------------
Si 16
==================================================
CTIFOR ( CALGO = 0 )
--------------------------------------------------
.02
==================================================
Primitive lattice vectors (ang.)
--------------------------------------------------
0.000000000000000e+00 5.468925910000000e+00 5.468925910000000e+00
5.468925910000000e+00 0.000000000000000e+00 5.468925910000000e+00
5.468925910000000e+00 5.468925910000000e+00 0.000000000000000e+00
==================================================
Atomic positions (ang.)
--------------------------------------------------
5.450241215249967e+00 5.417511279667131e+00 3.488677058322190e-02
1.089580671760392e-01 2.750843427196373e+00 2.712445660868190e+00
2.796387110875598e+00 5.517306106791707e+00 8.179990120183325e+00
8.167879785337480e+00 8.209635034660330e+00 5.542888976549058e+00
8.044073857762086e+00 2.986346806936125e+00 5.309421021654490e+00
2.823144487161382e+00 5.401476717034566e+00 2.806369596028380e+00
5.548248742697895e+00 8.206690674328904e+00 8.230461142039683e+00
5.303857100501434e+00 5.604084179290113e+00 5.496823666716538e+00
1.511626434516548e+00 1.232998714541637e+00 1.214400647578018e+00
1.417295119065322e+00 3.930296435045791e+00 4.164756289032656e+00
4.098271650529967e+00 1.405158369307332e+00 4.132998455030322e+00
4.146882854752111e+00 4.000839290019994e+00 6.963759843442116e+00
4.072665483148239e+00 3.891507476447266e+00 1.300692641941544e+00
4.077231981593830e+00 6.939456155455113e+00 4.151951455285499e+00
6.677144429040095e+00 4.249381573535850e+00 4.090600716291565e+00
6.852128729349046e+00 6.821430609120293e+00 6.763589936153915e+00
==================================================
Total energy (eV)
--------------------------------------------------
-8.533343154000001e+01
==================================================
Forces (eV ang.^-1)
--------------------------------------------------
-1.612813300000000e-01 -7.553351500000000e-01 -6.120779300000000e-01
4.514014900000000e-01 -2.117159160000000e+00 2.823892000000000e-02
-1.206772300000000e-01 -6.119254500000000e-01 6.353363300000000e-01
1.508191550000000e+00 -5.426973400000000e-01 1.746115600000000e-01
7.873919700000001e-01 -2.561729480000000e+00 8.368872000000001e-01
-4.886352500000000e-01 -1.467825800000000e-01 -6.781786200000000e-01
-6.802662500000000e-01 -7.942097299999999e-01 -5.884708100000000e-01
5.093272500000000e-01 -1.175245260000000e+00 7.931456300000000e-01
-8.426402200000001e-01 1.778953390000000e+00 2.426887900000000e-01
-5.146212300000000e-01 2.480107550000000e+00 -5.788237600000000e-01
4.600360600000000e-01 -8.965739000000000e-02 1.853850900000000e-01
-5.597103700000000e-01 1.269968990000000e+00 -1.045925400000000e+00
4.612646800000000e-01 1.825828190000000e+00 1.043897230000000e+00
-7.241301500000000e-01 7.895085200000000e-01 -1.281966900000000e+00
-1.490980400000000e-01 1.487030790000000e+00 -8.840338700000000e-01
6.344706999999999e-02 -8.366558900000000e-01 1.729286550000000e+00
==================================================
Stress (kbar)
--------------------------------------------------
XX YY ZZ
--------------------------------------------------
5.679890000000000e+00 -2.211530000000000e+00 3.391140000000000e+00
--------------------------------------------------
XY YZ ZX
--------------------------------------------------
-2.784120000000000e+00 -7.749280000000000e+00 3.143226000000000e+01
