#include "catch/catch.hpp" #include "teqp/models/multifluid.hpp" #include "teqp/algorithms/critical_tracing.hpp" #include "teqp/filesystem.hpp" TEST_CASE("Confirm failure for missing files","[multifluid]") { CHECK_THROWS(build_multifluid_model({ "BADFLUID" }, "IMPOSSIBLE PATH", "IMPOSSIBLE PATH.json")); CHECK_THROWS(build_multifluid_model({ "BADFLUID" }, "IMPOSSIBLE PATH", "../mycp/dev/mixtures/mixture_binary_pairs.json")); } TEST_CASE("Trace critical locus for nitrogen + ethane", "[crit],[multifluid]") { std::string root = "../mycp"; const auto model = build_multifluid_model({ "Nitrogen", "Ethane" }, root, root+"/dev/mixtures/mixture_binary_pairs.json"); for (auto ifluid = 0; ifluid < 2; ++ifluid) { double T0 = model.redfunc.Tc[ifluid]; Eigen::ArrayXd rhovec0(2); rhovec0 = 0.0; rhovec0[ifluid] = 1.0 / model.redfunc.vc[ifluid]; auto tic0 = std::chrono::steady_clock::now(); std::string filename = ""; using ct = CriticalTracing<decltype(model), double, Eigen::ArrayXd>; TCABOptions opt; opt.init_dt = 100; opt.integration_order = 1; auto j = ct::trace_critical_arclength_binary(model, T0, rhovec0, filename, opt); CHECK(j.size() > 3); auto tic1 = std::chrono::steady_clock::now(); } for (auto ifluid = 0; ifluid < 2; ++ifluid) { double T0 = model.redfunc.Tc[ifluid]; Eigen::ArrayXd rhovec0(2); rhovec0 = 0.0; rhovec0[ifluid] = 1.0 / model.redfunc.vc[ifluid]; auto tic0 = std::chrono::steady_clock::now(); std::string filename = ""; using ct = CriticalTracing<decltype(model), double, Eigen::ArrayXd>; TCABOptions opt; opt.max_dt = 10000; opt.init_dt = 10; opt.abs_err = 1e-8; opt.rel_err = 1e-6; opt.small_T_count = 100; auto j = ct::trace_critical_arclength_binary(model, T0, rhovec0, filename, opt); CHECK(j.size() > 3); auto tic1 = std::chrono::steady_clock::now(); } } TEST_CASE("Check that all pure fluid models can be instantiated", "[multifluid],[all]"){ std::string root = "../mycp"; SECTION("With absolute paths to json file") { for (auto path : get_files_in_folder(root + "/dev/fluids", ".json")) { if (path.filename().stem() == "Methanol") { continue; } CAPTURE(path.string()); auto abspath = std::filesystem::absolute(path).string(); auto model = build_multifluid_model({ abspath }, root, root + "/dev/mixtures/mixture_binary_pairs.json"); } } SECTION("With filename stems") { for (auto path : get_files_in_folder(root + "/dev/fluids", ".json")) { auto stem = path.filename().stem().string(); // filename without the .json if (stem == "Methanol") { continue; } auto model = build_multifluid_model({ stem }, root, root + "/dev/mixtures/mixture_binary_pairs.json"); } } }