v1.0.0-rc.148 (#58)

This is an UNSTABLE release. The release has significant modifications for data processing - in case of troubles go back to 1.0.0-rc.144.

* jfjoch_broker: Improve azimuthal integration (add <I^2> calculation)
* jfjoch_broker: Fixes around indexing, aiming to handle multi-lattice crystals (work in progress, it is not fully integrated)
* jfjoch_writer: Save mean(I), stddev(I), and count(I) for each azimuthal bin

Reviewed-on: #58

tests/JFJochReaderTest.cpp

@@ -1211,10 +1211,10 @@ TEST_CASE("JFJochReader_Spots_OldMasterFormat", "[HDF5][Full]") {
             std::vector<SpotToSave> spots;
             spots.push_back(SpotToSave{
                 .x = 1, .y = 2, .intensity = 376,
-                .ice_ring = true,
-                .indexed = true,
                 .h = 11, .k = -3, .l = -5,
-                .dist_ewald_sphere = 0.1234f
+                .dist_ewald_sphere = 0.1234f,
+                .ice_ring = true,
+                .indexed = true
             });
             spots.push_back(SpotToSave{
                 .x = 7, .y = -3, .intensity = 0.156f,
@@ -1308,10 +1308,10 @@ TEST_CASE("JFJochReader_Spots_VDS", "[HDF5][Full]") {
             std::vector<SpotToSave> spots;
             spots.push_back(SpotToSave{
                 .x = 1, .y = 2, .intensity = 376,
-                .ice_ring = true,
-                .indexed = true,
                 .h = 11, .k = -3, .l = -5,
-                .dist_ewald_sphere = 0.1234f
+                .dist_ewald_sphere = 0.1234f,
+                .ice_ring = true,
+                .indexed = true
             });
             spots.push_back(SpotToSave{
                 .x = 7, .y = -3, .intensity = 0.156f,
@@ -2127,10 +2127,10 @@ static std::vector<SpotToSave> MakeTestSpots(int i) {
     return {
         SpotToSave{
             .x = 1, .y = 2, .intensity = 376,
-            .ice_ring = true,
-            .indexed = true,
             .h = 11, .k = -3, .l = -5,
-            .dist_ewald_sphere = 0.1234f
+            .dist_ewald_sphere = 0.1234f,
+            .ice_ring = true,
+            .indexed = true
         },
         SpotToSave{
             .x = 7, .y = static_cast<float>(-3 - i), .intensity = 0.156f,