From adfa88ff26c84496fbad9c63fe0382f09da2d6bd Mon Sep 17 00:00:00 2001
From: kamischi <karl-michael.schindler@web.de>
Date: Sun, 27 Feb 2022 20:18:26 +0100
Subject: [PATCH] Update divers files.
---
.gitignore | 2 +
source/Lazarus-GUI/EELS.lpi | 4 +-
source/Lazarus-GUI/EELS.lps | 113 ++-
tests/BOSOU | 1694 +++++++++++++++++------------------
tests/EELSIN | 15 +-
5 files changed, 915 insertions(+), 913 deletions(-)
create mode 100644 .gitignore
diff --git a/.gitignore b/.gitignore
new file mode 100644
index 0000000..9bea433
--- /dev/null
+++ b/.gitignore
@@ -0,0 +1,2 @@
+
+.DS_Store
diff --git a/source/Lazarus-GUI/EELS.lpi b/source/Lazarus-GUI/EELS.lpi
index 75e6d19..8f519d2 100644
--- a/source/Lazarus-GUI/EELS.lpi
+++ b/source/Lazarus-GUI/EELS.lpi
@@ -151,6 +151,8 @@
<CodeGeneration>
<SmartLinkUnit Value="True"/>
<RelocatableUnit Value="True"/>
+ <TargetCPU Value="x86_64"/>
+ <TargetOS Value="darwin"/>
</CodeGeneration>
<Linking>
<Debugging>
@@ -158,7 +160,7 @@
</Debugging>
<Options>
<PassLinkerOptions Value="True"/>
- <LinkerOptions Value="-lgfortran -L/opt/sw/lib/gcc9/lib ../f90/doeels.o ../f90/usurlo.o ../f90/quanc8.o ../f90/fun.o ../f90/queels.o ../f90/fint1.o ../f90/fint2.o ../f90/fint3.o ../f90/surlos.o ../f90/seteps.o ../f90/phint.o ../f90/qrat.o ../f90/doboson.o ../f90/respon.o ../f90/sicot.o ../f90/sintr.o ../f90/rcffi.o ../f90/o1.o ../f90/o2.o"/>
+ <LinkerOptions Value="-lgfortran -L/opt/local/lib/gcc11 ../f90/doeels.o ../f90/usurlo.o ../f90/quanc8.o ../f90/fun.o ../f90/queels.o ../f90/fint1.o ../f90/fint2.o ../f90/fint3.o ../f90/surlos.o ../f90/seteps.o ../f90/phint.o ../f90/qrat.o ../f90/doboson.o ../f90/respon.o ../f90/sicot.o ../f90/sintr.o ../f90/rcffi.o ../f90/o1.o ../f90/o2.o"/>
<Win32>
<GraphicApplication Value="True"/>
</Win32>
diff --git a/source/Lazarus-GUI/EELS.lps b/source/Lazarus-GUI/EELS.lps
index 13f64a5..2891db0 100644
--- a/source/Lazarus-GUI/EELS.lps
+++ b/source/Lazarus-GUI/EELS.lps
@@ -2,7 +2,7 @@
<CONFIG>
<ProjectSession>
<Version Value="11"/>
- <Units Count="10">
+ <Units Count="11">
<Unit0>
<Filename Value="EELS.lpr"/>
<IsPartOfProject Value="True"/>
@@ -45,8 +45,9 @@
<Filename Value="../f90/doeels.f90"/>
<IsPartOfProject Value="True"/>
<EditorIndex Value="5"/>
- <CursorPos Y="189"/>
- <UsageCount Value="138"/>
+ <TopLine Value="180"/>
+ <CursorPos X="14" Y="188"/>
+ <UsageCount Value="143"/>
<Loaded Value="True"/>
<DefaultSyntaxHighlighter Value="None"/>
</Unit4>
@@ -56,7 +57,7 @@
<EditorIndex Value="6"/>
<TopLine Value="73"/>
<CursorPos Y="98"/>
- <UsageCount Value="143"/>
+ <UsageCount Value="148"/>
<Loaded Value="True"/>
<DefaultSyntaxHighlighter Value="None"/>
</Unit5>
@@ -69,7 +70,7 @@
<EditorIndex Value="2"/>
<TopLine Value="29"/>
<CursorPos X="33" Y="45"/>
- <UsageCount Value="112"/>
+ <UsageCount Value="117"/>
<Loaded Value="True"/>
<LoadedDesigner Value="True"/>
</Unit6>
@@ -95,128 +96,124 @@
<CursorPos Y="2539"/>
<UsageCount Value="10"/>
</Unit9>
+ <Unit10>
+ <Filename Value="/opt/sw/share/lazarus/components/codetools/fileprocs.pas"/>
+ <UnitName Value="FileProcs"/>
+ <EditorIndex Value="-1"/>
+ <TopLine Value="1513"/>
+ <CursorPos X="3" Y="1527"/>
+ <UsageCount Value="10"/>
+ </Unit10>
</Units>
- <JumpHistory Count="30" HistoryIndex="29">
+ <JumpHistory Count="27" HistoryIndex="26">
<Position1>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="365" Column="52" TopLine="343"/>
+ <Filename Value="UDiagramm.pas"/>
+ <Caret Line="4"/>
</Position1>
<Position2>
<Filename Value="UMainForm.pas"/>
- <Caret Line="366" Column="19" TopLine="344"/>
+ <Caret Line="384" Column="43" TopLine="374"/>
</Position2>
<Position3>
<Filename Value="UMainForm.pas"/>
- <Caret Line="255" TopLine="255"/>
+ <Caret Line="253" TopLine="233"/>
</Position3>
<Position4>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="345" Column="89" TopLine="333"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="86" Column="40" TopLine="81"/>
</Position4>
<Position5>
- <Filename Value="UDiagramm.pas"/>
- <Caret Line="4"/>
+ <Filename Value="UMainForm.pas"/>
+ <Caret Line="391" TopLine="312"/>
</Position5>
<Position6>
<Filename Value="UMainForm.pas"/>
- <Caret Line="384" Column="43" TopLine="374"/>
+ <Caret Line="264" Column="53" TopLine="251"/>
</Position6>
<Position7>
<Filename Value="UMainForm.pas"/>
- <Caret Line="253" TopLine="233"/>
+ <Caret Line="253" Column="57" TopLine="251"/>
</Position7>
<Position8>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="86" Column="40" TopLine="81"/>
+ <Filename Value="UDiagramm.pas"/>
+ <Caret Line="4"/>
</Position8>
<Position9>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="391" TopLine="312"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="168" Column="9" TopLine="148"/>
</Position9>
<Position10>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="264" Column="53" TopLine="251"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="167" Column="35" TopLine="141"/>
</Position10>
<Position11>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="253" Column="57" TopLine="251"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="168" Column="12" TopLine="145"/>
</Position11>
<Position12>
- <Filename Value="UDiagramm.pas"/>
- <Caret Line="4"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="169" Column="12" TopLine="146"/>
</Position12>
<Position13>
<Filename Value="UFileIO.pas"/>
- <Caret Line="168" Column="9" TopLine="148"/>
+ <Caret Line="170" Column="12" TopLine="147"/>
</Position13>
<Position14>
<Filename Value="UFileIO.pas"/>
- <Caret Line="167" Column="35" TopLine="141"/>
+ <Caret Line="171" Column="12" TopLine="148"/>
</Position14>
<Position15>
<Filename Value="UFileIO.pas"/>
- <Caret Line="168" Column="12" TopLine="145"/>
+ <Caret Line="172" Column="12" TopLine="149"/>
</Position15>
<Position16>
<Filename Value="UFileIO.pas"/>
- <Caret Line="169" Column="12" TopLine="146"/>
+ <Caret Line="173" Column="12" TopLine="150"/>
</Position16>
<Position17>
<Filename Value="UFileIO.pas"/>
- <Caret Line="170" Column="12" TopLine="147"/>
+ <Caret Line="174" Column="12" TopLine="151"/>
</Position17>
<Position18>
<Filename Value="UFileIO.pas"/>
- <Caret Line="171" Column="12" TopLine="148"/>
+ <Caret Line="175" Column="12" TopLine="152"/>
</Position18>
<Position19>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="172" Column="12" TopLine="149"/>
+ <Filename Value="UDiagramm.pas"/>
+ <Caret Line="14"/>
</Position19>
<Position20>
<Filename Value="UFileIO.pas"/>
- <Caret Line="173" Column="12" TopLine="150"/>
+ <Caret Line="158" Column="26" TopLine="144"/>
</Position20>
<Position21>
<Filename Value="UFileIO.pas"/>
- <Caret Line="174" Column="12" TopLine="151"/>
+ <Caret Line="190" Column="26" TopLine="177"/>
</Position21>
<Position22>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="175" Column="12" TopLine="152"/>
+ <Filename Value="UMainForm.pas"/>
+ <Caret Line="403" Column="3" TopLine="233"/>
</Position22>
<Position23>
- <Filename Value="UDiagramm.pas"/>
- <Caret Line="14"/>
+ <Filename Value="UFileIO.pas"/>
+ <Caret Line="184" Column="104" TopLine="167"/>
</Position23>
<Position24>
<Filename Value="UFileIO.pas"/>
- <Caret Line="158" Column="26" TopLine="144"/>
+ <Caret Line="265" Column="42" TopLine="242"/>
</Position24>
<Position25>
<Filename Value="UFileIO.pas"/>
- <Caret Line="190" Column="26" TopLine="177"/>
+ <Caret Line="260" Column="53" TopLine="245"/>
</Position25>
<Position26>
- <Filename Value="UMainForm.pas"/>
- <Caret Line="403" Column="3" TopLine="233"/>
+ <Filename Value="UDiagramm.pas"/>
+ <Caret Line="14"/>
</Position26>
<Position27>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="184" Column="104" TopLine="167"/>
+ <Filename Value="../f90/doeels.f90"/>
+ <Caret Line="188" Column="14" TopLine="180"/>
</Position27>
- <Position28>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="265" Column="42" TopLine="242"/>
- </Position28>
- <Position29>
- <Filename Value="UFileIO.pas"/>
- <Caret Line="260" Column="53" TopLine="245"/>
- </Position29>
- <Position30>
- <Filename Value="UDiagramm.pas"/>
- <Caret Line="14"/>
- </Position30>
</JumpHistory>
<RunParams>
<FormatVersion Value="2"/>
diff --git a/tests/BOSOU b/tests/BOSOU
index 1a1bf24..ba3fa57 100644
--- a/tests/BOSOU
+++ b/tests/BOSOU
@@ -1,853 +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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- 0.1098000E+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
+ 0.1062000E+04 0.1106105E-02
+ 0.1064000E+04 0.1010503E-02
+ 0.1066000E+04 0.9245703E-03
+ 0.1068000E+04 0.8476286E-03
+ 0.1070000E+04 0.7788934E-03
+ 0.1072000E+04 0.7175451E-03
+ 0.1074000E+04 0.6627788E-03
+ 0.1076000E+04 0.6138364E-03
+ 0.1078000E+04 0.5700235E-03
+ 0.1080000E+04 0.5307163E-03
+ 0.1082000E+04 0.4953623E-03
+ 0.1084000E+04 0.4634761E-03
+ 0.1086000E+04 0.4346340E-03
+ 0.1088000E+04 0.4084681E-03
+ 0.1090000E+04 0.3846589E-03
+ 0.1092000E+04 0.3629303E-03
+ 0.1094000E+04 0.3430430E-03
+ 0.1096000E+04 0.3247905E-03
+ 0.1098000E+04 0.3079939E-03
+ 0.1100000E+04 0.2924982E-03
+ 0.1102000E+04 0.2781693E-03
+ 0.1104000E+04 0.2648904E-03
+ 0.1106000E+04 0.2525596E-03
+ 0.1108000E+04 0.2410879E-03
+ 0.1110000E+04 0.2303970E-03
+ 0.1112000E+04 0.2204177E-03
+ 0.1114000E+04 0.2110888E-03
+ 0.1116000E+04 0.2023557E-03
+ 0.1118000E+04 0.1941698E-03
+ 0.1120000E+04 0.1864871E-03
+ 0.1122000E+04 0.1792683E-03
+ 0.1124000E+04 0.1724778E-03
+ 0.1126000E+04 0.1660832E-03
+ 0.1128000E+04 0.1600551E-03
+ 0.1130000E+04 0.1543669E-03
+ 0.1132000E+04 0.1489941E-03
+ 0.1134000E+04 0.1439144E-03
+ 0.1136000E+04 0.1391074E-03
+ 0.1138000E+04 0.1345543E-03
+ 0.1140000E+04 0.1302380E-03
+ 0.1142000E+04 0.1261426E-03
+ 0.1144000E+04 0.1222535E-03
+ 0.1146000E+04 0.1185574E-03
+ 0.1148000E+04 0.1150419E-03
+ 0.1150000E+04 0.1116955E-03
+ 0.1152000E+04 0.1085077E-03
+ 0.1154000E+04 0.1054688E-03
+ 0.1156000E+04 0.1025698E-03
+ 0.1158000E+04 0.9980212E-04
+ 0.1160000E+04 0.9715816E-04
+ 0.1162000E+04 0.9463060E-04
+ 0.1164000E+04 0.9221267E-04
+ 0.1166000E+04 0.8989803E-04
+ 0.1168000E+04 0.8768069E-04
+ 0.1170000E+04 0.8555502E-04
+ 0.1172000E+04 0.8351563E-04
+ 0.1174000E+04 0.8155740E-04
+ 0.1176000E+04 0.7967537E-04
+ 0.1178000E+04 0.7786473E-04
+ 0.1180000E+04 0.7612075E-04
+ 0.1182000E+04 0.7443871E-04
+ 0.1184000E+04 0.7281386E-04
+ 0.1186000E+04 0.7124135E-04
+ 0.1188000E+04 0.6971620E-04
+ 0.1190000E+04 0.6823320E-04
+ 0.1192000E+04 0.6678697E-04
+ 0.1194000E+04 0.6537192E-04
+ 0.1196000E+04 0.6398237E-04
+ 0.1198000E+04 0.6261264E-04
+ 0.1200000E+04 0.6125732E-04
diff --git a/tests/EELSIN b/tests/EELSIN
index 7a76a45..1db7dba 100644
--- a/tests/EELSIN
+++ b/tests/EELSIN
@@ -5,11 +5,12 @@
50.0 WMIN ABTI0006
700.0 WMAX ABTI0007
2.0 DW ABTI0008
-WFW test: One layer
+WFW: MnO layer on metal
ABTI0010
- 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
+ 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
--
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