From 61df048a709ac8f65ab34ab26ee53c7a24eb0568 Mon Sep 17 00:00:00 2001
From: michael <michael@7e267752-d5d8-41c0-93cd-a7fa012602f9>
Date: Fri, 17 Apr 2015 13:28:05 +0000
Subject: [PATCH] update some input and output files

git-svn-id: svn+ssh://michael-ep3.physik.uni-halle.de/Users/Shared/EELS2@62 7e267752-d5d8-41c0-93cd-a7fa012602f9
---
 data/EELSIN  |  10 +-
 tests/BOSOU  | 853 +++++++++++++++++++++++++++++++++++++++++++++++++++
 tests/EELSIN |  15 +-
 tests/EELSOU | 654 +++++++++++++++++++--------------------
 4 files changed, 1192 insertions(+), 340 deletions(-)
 create mode 100644 tests/BOSOU

diff --git a/data/EELSIN b/data/EELSIN
index 2c9c77f..1db7dba 100644
--- a/data/EELSIN
+++ b/data/EELSIN
@@ -7,10 +7,10 @@
    2.0      DW                                                          ABTI0008
 WFW: MnO layer on metal
                                                                         ABTI0010
-    2    1                                          N  NPER             ABTI0011
-MnO            99.400D+01                           LAYER 1             ABTI0012
-    4.95      1                                                         ABTI0013
-   269.0          16.000        5.00000E-02                             ABTI0014
-Platinum      100.000D+01                           LAYER 2             ABTI0012
+    2    1                                          No-layers  NPER No-periodic
+MnO            994.00D+00                           LAYER 1  name thickness
+    4.95      1                                              epsinf No-Osc.
+   269.0          16.000        5.00000E-02                  wto, Q, lambda
+Platinum      1000.00D+00                           LAYER 2             ABTI0012
     8.90      1                                                         ABTI0013
 160000.0          -1            12.0000E-02                             ABTI0014
diff --git a/tests/BOSOU b/tests/BOSOU
new file mode 100644
index 0000000..1a1bf24
--- /dev/null
+++ b/tests/BOSOU
@@ -0,0 +1,853 @@
+E0 =  4.00 THETA = 60.0 PHIA = 1.80 PHIB = 1.80 T = 300.0 GAUSS = 0.50
+WFW: MnO layer on metal                                                 
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+  0.1052000E+04  0.1731276E-02
+  0.1054000E+04  0.1588898E-02
+  0.1056000E+04  0.1453868E-02
+  0.1058000E+04  0.1327874E-02
+  0.1060000E+04  0.1211847E-02
+  0.1062000E+04  0.1106107E-02
+  0.1064000E+04  0.1010507E-02
+  0.1066000E+04  0.9245756E-03
+  0.1068000E+04  0.8476348E-03
+  0.1070000E+04  0.7789002E-03
+  0.1072000E+04  0.7175518E-03
+  0.1074000E+04  0.6627854E-03
+  0.1076000E+04  0.6138426E-03
+  0.1078000E+04  0.5700293E-03
+  0.1080000E+04  0.5307217E-03
+  0.1082000E+04  0.4953676E-03
+  0.1084000E+04  0.4634813E-03
+  0.1086000E+04  0.4346394E-03
+  0.1088000E+04  0.4084735E-03
+  0.1090000E+04  0.3846647E-03
+  0.1092000E+04  0.3629365E-03
+  0.1094000E+04  0.3430498E-03
+  0.1096000E+04  0.3247979E-03
+  0.1098000E+04  0.3080017E-03
+  0.1100000E+04  0.2925066E-03
+  0.1102000E+04  0.2781780E-03
+  0.1104000E+04  0.2648988E-03
+  0.1106000E+04  0.2525677E-03
+  0.1108000E+04  0.2410957E-03
+  0.1110000E+04  0.2304043E-03
+  0.1112000E+04  0.2204244E-03
+  0.1114000E+04  0.2110952E-03
+  0.1116000E+04  0.2023620E-03
+  0.1118000E+04  0.1941758E-03
+  0.1120000E+04  0.1864932E-03
+  0.1122000E+04  0.1792745E-03
+  0.1124000E+04  0.1724842E-03
+  0.1126000E+04  0.1660899E-03
+  0.1128000E+04  0.1600622E-03
+  0.1130000E+04  0.1543743E-03
+  0.1132000E+04  0.1490018E-03
+  0.1134000E+04  0.1439223E-03
+  0.1136000E+04  0.1391151E-03
+  0.1138000E+04  0.1345617E-03
+  0.1140000E+04  0.1302450E-03
+  0.1142000E+04  0.1261492E-03
+  0.1144000E+04  0.1222597E-03
+  0.1146000E+04  0.1185633E-03
+  0.1148000E+04  0.1150476E-03
+  0.1150000E+04  0.1117009E-03
+  0.1152000E+04  0.1085125E-03
+  0.1154000E+04  0.1054735E-03
+  0.1156000E+04  0.1025745E-03
+  0.1158000E+04  0.9980696E-04
+  0.1160000E+04  0.9716312E-04
+  0.1162000E+04  0.9463572E-04
+  0.1164000E+04  0.9221784E-04
+  0.1166000E+04  0.8990312E-04
+  0.1168000E+04  0.8768533E-04
+  0.1170000E+04  0.8555916E-04
+  0.1172000E+04  0.8351916E-04
+  0.1174000E+04  0.8156033E-04
+  0.1176000E+04  0.7967777E-04
+  0.1178000E+04  0.7786663E-04
+  0.1180000E+04  0.7612245E-04
+  0.1182000E+04  0.7444029E-04
+  0.1184000E+04  0.7281532E-04
+  0.1186000E+04  0.7124283E-04
+  0.1188000E+04  0.6971787E-04
+  0.1190000E+04  0.6823510E-04
+  0.1192000E+04  0.6678928E-04
+  0.1194000E+04  0.6537449E-04
+  0.1196000E+04  0.6398530E-04
+  0.1198000E+04  0.6261564E-04
+  0.1200000E+04  0.6126019E-04
diff --git a/tests/EELSIN b/tests/EELSIN
index 2c9c77f..7a76a45 100644
--- a/tests/EELSIN
+++ b/tests/EELSIN
@@ -5,12 +5,11 @@
   50.0      WMIN                                                        ABTI0006
  700.0      WMAX                                                        ABTI0007
    2.0      DW                                                          ABTI0008
-WFW: MnO layer on metal
+WFW test: One layer
                                                                         ABTI0010
-    2    1                                          N  NPER             ABTI0011
-MnO            99.400D+01                           LAYER 1             ABTI0012
-    4.95      1                                                         ABTI0013
-   269.0          16.000        5.00000E-02                             ABTI0014
-Platinum      100.000D+01                           LAYER 2             ABTI0012
-    8.90      1                                                         ABTI0013
-160000.0          -1            12.0000E-02                             ABTI0014
+    1    1                                          N  NPER             ABTI0011
+BaTiO3        0.70000D+02                           LAYER 1             ABTI0012
+    8.90      3                                                         ABTI0013
+   180.0          0.2300        1.00000E-02                             ABTI0014
+   295.0          6.5300        5.00000E-02                             ABTI0014
+   520.0          5.0300        28.0000E-02                             ABTI0014
diff --git a/tests/EELSOU b/tests/EELSOU
index 23e5028..dcba483 100644
--- a/tests/EELSOU
+++ b/tests/EELSOU
@@ -1,328 +1,328 @@
 E0 =  4.00 THETA = 60.0 PHIA = 1.80 PHIB = 1.80
-WFW: MnO layer on metal                                                 
-  0.5000000E+02  0.3941008E-04
-  0.5200000E+02  0.3978564E-04
-  0.5400000E+02  0.4013988E-04
-  0.5600000E+02  0.4047467E-04
-  0.5800000E+02  0.4079174E-04
-  0.6000000E+02  0.4109263E-04
-  0.6200000E+02  0.4137881E-04
-  0.6400000E+02  0.4108543E-04
-  0.6600000E+02  0.4191212E-04
-  0.6800000E+02  0.4216160E-04
-  0.7000000E+02  0.4240102E-04
-  0.7200000E+02  0.4263132E-04
-  0.7400000E+02  0.4285339E-04
-  0.7600000E+02  0.4306802E-04
-  0.7800000E+02  0.4327598E-04
-  0.8000000E+02  0.4347794E-04
-  0.8200000E+02  0.4367455E-04
-  0.8400000E+02  0.4386642E-04
-  0.8600000E+02  0.4405408E-04
-  0.8800000E+02  0.4423806E-04
-  0.9000000E+02  0.4441884E-04
-  0.9200000E+02  0.4459685E-04
-  0.9400000E+02  0.4477229E-04
-  0.9600000E+02  0.4494627E-04
-  0.9800000E+02  0.4511842E-04
-  0.1000000E+03  0.4528933E-04
-  0.1020000E+03  0.4545934E-04
-  0.1040000E+03  0.4562873E-04
-  0.1060000E+03  0.4579779E-04
-  0.1080000E+03  0.4596680E-04
-  0.1100000E+03  0.4613601E-04
-  0.1120000E+03  0.4630565E-04
-  0.1140000E+03  0.4647599E-04
-  0.1160000E+03  0.4664720E-04
-  0.1180000E+03  0.4681948E-04
-  0.1200000E+03  0.4699305E-04
-  0.1220000E+03  0.4716812E-04
-  0.1240000E+03  0.4734485E-04
-  0.1260000E+03  0.4752340E-04
-  0.1280000E+03  0.4770396E-04
-  0.1300000E+03  0.4788669E-04
-  0.1320000E+03  0.4807174E-04
-  0.1340000E+03  0.4825916E-04
-  0.1360000E+03  0.4844937E-04
-  0.1380000E+03  0.4864227E-04
-  0.1400000E+03  0.4883806E-04
-  0.1420000E+03  0.4903689E-04
-  0.1440000E+03  0.4923889E-04
-  0.1460000E+03  0.4944419E-04
-  0.1480000E+03  0.4965293E-04
-  0.1500000E+03  0.4986523E-04
-  0.1520000E+03  0.5008121E-04
-  0.1540000E+03  0.5030101E-04
-  0.1560000E+03  0.5052510E-04
-  0.1580000E+03  0.5075290E-04
-  0.1600000E+03  0.5098491E-04
-  0.1620000E+03  0.5122123E-04
-  0.1640000E+03  0.5146198E-04
-  0.1660000E+03  0.5170732E-04
-  0.1680000E+03  0.5195733E-04
-  0.1700000E+03  0.5221217E-04
-  0.1720000E+03  0.5247163E-04
-  0.1740000E+03  0.5273653E-04
-  0.1760000E+03  0.5300666E-04
-  0.1780000E+03  0.5328235E-04
-  0.1800000E+03  0.5356326E-04
-  0.1820000E+03  0.5384979E-04
-  0.1840000E+03  0.5414207E-04
-  0.1860000E+03  0.5444027E-04
-  0.1880000E+03  0.5474452E-04
-  0.1900000E+03  0.5505496E-04
-  0.1920000E+03  0.5537174E-04
-  0.1940000E+03  0.5569503E-04
-  0.1960000E+03  0.5602499E-04
-  0.1980000E+03  0.5636178E-04
-  0.2000000E+03  0.5670564E-04
-  0.2020000E+03  0.5705659E-04
-  0.2040000E+03  0.5741487E-04
-  0.2060000E+03  0.5778067E-04
-  0.2080000E+03  0.5815417E-04
-  0.2100000E+03  0.5853558E-04
-  0.2120000E+03  0.5892508E-04
-  0.2140000E+03  0.5932287E-04
-  0.2160000E+03  0.5972919E-04
-  0.2180000E+03  0.6014421E-04
-  0.2200000E+03  0.6056817E-04
-  0.2220000E+03  0.6100130E-04
-  0.2240000E+03  0.6144381E-04
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-  0.2300000E+03  0.6283023E-04
-  0.2320000E+03  0.6331285E-04
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-  0.2440000E+03  0.6644327E-04
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-- 
GitLab